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4-(2-cyanoanilino)-2-keto-6-(3-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid ethyl ester
SpectraBase Compound ID GxhsaDCh3v4
InChI InChI=1S/C23H22N2O4/c1-3-29-23(27)22-19(15-8-6-9-18(11-15)28-2)12-17(13-21(22)26)25-20-10-5-4-7-16(20)14-24/h4-11,13,19,22,25H,3,12H2,1-2H3
InChIKey ODOVRRLXVHBQDS-UHFFFAOYSA-N
Mol Weight 390.44 g/mol
Molecular Formula C23H22N2O4
Exact Mass 390.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rq2N7PbOor
Name 4-(2-cyanoanilino)-2-keto-6-(3-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22N2O4
InChI InChI=1S/C23H22N2O4/c1-3-29-23(27)22-19(15-8-6-9-18(11-15)28-2)12-17(13-21(22)26)25-20-10-5-4-7-16(20)14-24/h4-11,13,19,22,25H,3,12H2,1-2H3
InChIKey ODOVRRLXVHBQDS-UHFFFAOYSA-N
Molecular Weight 390.439 g/mol
SMILES N(C=1CC(C(C(C1)=O)C(=O)OCC)c1cccc(c1)OC)c1ccccc1C#N
SPLASH splash10-0159-2933000000-1af0bcdbc9f28f79383e
Synonyms 4-(2-cyanoanilino)-6-(3-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester Ethyl 4-(2-cyanoanilino)-6-(3-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate Ethyl 4-[(2-cyanophenyl)amino]-6-(3-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate
Wiley ID 1511533