methyl 4-[(E)-3-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C=CC3=CC=C(C=C3)C(=O)OC)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)/C=C/C3=CC=C(C=C3)C(=O)OC)OCO2

InChI

InChI=1S/C20H17NO6/c1-12(22)15-9-17-18(27-11-26-17)10-16(15)21-19(23)8-5-13-3-6-14(7-4-13)20(24)25-2/h3-10H,11H2,1-2H3,(H,21,23)/b8-5+