methyl 2-(3,4-dimethoxyphenyl)-7-methyl-9-oxidanyl-5-oxidanylidene-6,9-dihydropyrido[3,2-c]azepine-8-carboxylate

Systemtic Name: methyl 2-(3,4-dimethoxyphenyl)-7-methyl-9-oxidanyl-5-oxidanylidene-6,9-dihydropyrido[3,2-c]azepine-8-carboxylate Openeye Name: methyl 2-(3,4-dimethoxyphenyl)-9-hydroxy-7-methyl-5-oxo-6,9-dihydropyrido[3,2-c]azepine-8-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-9-hydroxy-7-methyl-5-oxo-6,9-dihydropyrido[3,2-c]azepine-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(3,4-dimethoxyphenyl)-9-hydroxy-7-methyl-5-oxo-6,9-dihydropyrido[3,2-c]azepine-8-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)-9-hydroxy-5-keto-7-methyl-6,9-dihydropyrid[3,2-c]azepine-8-carboxylic acid methyl ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(C=CC(=N2)C3=CC(=C(C=C3)OC)OC)C(=O)N1)O)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(C=CC(=N2)C3=CC(=C(C=C3)OC)OC)C(=O)N1)O)C(=O)OC

InChI

InChI=1S/C20H20N2O6/c1-10-16(20(25)28-4)18(23)17-12(19(24)21-10)6-7-13(22-17)11-5-8-14(26-2)15(9-11)27-3/h5-9,18,23H,1-4H3,(H,21,24)