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Ethyl (5Z)-2-anilino-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-4,5-dihydro-3-thiophenecarboxylate
SpectraBase Compound ID BrYYyuXFY0G
InChI InChI=1S/C21H17NO5S/c1-2-25-21(24)18-19(23)17(28-20(18)22-14-6-4-3-5-7-14)11-13-8-9-15-16(10-13)27-12-26-15/h3-11,22H,2,12H2,1H3/b17-11-
InChIKey IIABLAMILDIEAR-BOPFTXTBSA-N
Mol Weight 395.43 g/mol
Molecular Formula C21H17NO5S
Exact Mass 395.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3xwXCdvZAo
Name Ethyl (5Z)-2-anilino-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-4,5-dihydro-3-thiophenecarboxylate
CAS Registry Number 309731-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NO5S
InChI InChI=1S/C21H17NO5S/c1-2-25-21(24)18-19(23)17(28-20(18)22-14-6-4-3-5-7-14)11-13-8-9-15-16(10-13)27-12-26-15/h3-11,22H,2,12H2,1H3/b17-11-
InChIKey IIABLAMILDIEAR-BOPFTXTBSA-N
Molecular Weight 395.429 g/mol
SMILES N(C1=C(C(=O)\C(S1)=C\c1cc2OCOc2cc1)C(=O)OCC)c1ccccc1
SPLASH splash10-002b-2916000000-19f6ccd96e8ce03601dd
Source of Spectrum AD-0-2532-0
Synonyms (5Z)-2-anilino-4-keto-5-piperonylidene-thiophene-3-carboxylic acid ethyl ester (5Z)-2-anilino-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-3-thiophenecarboxylic acid ethyl ester Ethyl (5Z)-2-anilino-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-thiophene-3-carboxylate Ethyl (5Z)-2-anilino-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxothiophene-3-carboxylate Ethyl (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Ethyl 2-anilino-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-4,5-dihydro-3-thiophenecarboxylate Thiophene-3-carboxylic acid, 4,5-dihydro-5-(1,3-benzodioxol-5-yl)-4-oxo-2-phenylamino-, ethyl ester
Wiley ID 1428970