ethyl 3-acetamido-4-(6-bromanyl-1,3-benzodioxol-5-yl)-6-(4-methylphenyl)-2-oxidanylidene-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 3-acetamido-4-(6-bromanyl-1,3-benzodioxol-5-yl)-6-(4-methylphenyl)-2-oxidanylidene-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 3-acetamido-4-(6-bromo-1,3-benzodioxol-5-yl)-2-oxo-6-(p-tolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 3-acetamido-4-(6-bromo-1,3-benzodioxol-5-yl)-6-(4-methylphenyl)-2-oxo-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 3-acetamido-4-(6-bromo-1,3-benzodioxol-5-yl)-6-(4-methylphenyl)-2-oxo-1,4-dihydropyridine-3-carboxylate Traditional Name: 3-acetamido-4-(6-bromo-1,3-benzodioxol-5-yl)-2-keto-6-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C24H23BrN2O6 MolecularWeight: 515.35322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C=C(NC1=O)C2=CC=C(C=C2)C)C3=CC4=C(C=C3Br)OCO4)NC(=O)C

Isomeric SMILES

CCOC(=O)C1(C(C=C(NC1=O)C2=CC=C(C=C2)C)C3=CC4=C(C=C3Br)OCO4)NC(=O)C

InChI

InChI=1S/C24H23BrN2O6/c1-4-31-23(30)24(27-14(3)28)17(16-9-20-21(11-18(16)25)33-12-32-20)10-19(26-22(24)29)15-7-5-13(2)6-8-15/h5-11,17H,4,12H2,1-3H3,(H,26,29)(H,27,28)