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Ethyl 4-(acetyl[(6-methyl[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino)benzoate
SpectraBase Compound ID 1DBrTwwEl1g
InChI InChI=1S/C22H21N3O5/c1-4-28-22(27)15-5-7-16(8-6-15)25(14(3)26)11-19-17-9-20-21(30-12-29-20)10-18(17)23-13(2)24-19/h5-10H,4,11-12H2,1-3H3
InChIKey AAJKHKVPQUCTAY-UHFFFAOYSA-N
Mol Weight 407.43 g/mol
Molecular Formula C22H21N3O5
Exact Mass 407.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3cSKwarm0ar
Name Ethyl 4-(acetyl[(6-methyl[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino)benzoate
CAS Registry Number 85591-06-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N3O5
InChI InChI=1S/C22H21N3O5/c1-4-28-22(27)15-5-7-16(8-6-15)25(14(3)26)11-19-17-9-20-21(30-12-29-20)10-18(17)23-13(2)24-19/h5-10H,4,11-12H2,1-3H3
InChIKey AAJKHKVPQUCTAY-UHFFFAOYSA-N
Molecular Weight 407.426 g/mol
SMILES CCOC(c1ccc(cc1)N(Cc1c2cc3c(cc2nc(C)n1)OCO3)C(C)=O)=O
SPLASH splash10-08fr-0109600000-34aaf3a958ded2fbb52f
Source of Spectrum W5-1989-35049-30487
Synonyms 4-[acetyl-[(6-methyl-[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino]benzoic acid ethyl ester Ethyl 4-[ethanoyl-[(6-methyl-[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino]benzoate Ethyl 4-[N-acetyl-N-(2-methyl-6,7-methylenedioxyquinazolin-4-ylmethyl)amino]benzoate
Wiley ID 1372568