ethyl 6-[(4-chlorophenyl)methyl]-4,5-dimethyl-2-oxidanylidene-7-phenyl-1H-pyrrolo[3,4-b]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[(4-chlorophenyl)methyl]-4,5-dimethyl-2-oxidanylidene-7-phenyl-1H-pyrrolo[3,4-b]pyridine-3-carboxylate Openeye Name: ethyl 6-[(4-chlorophenyl)methyl]-4,5-dimethyl-2-oxo-7-phenyl-1H-pyrrolo[3,4-b]pyridine-3-carboxylate CAS Name: 6-[(4-chlorophenyl)methyl]-4,5-dimethyl-2-oxo-7-phenyl-1H-pyrrolo[3,4-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-chlorophenyl)methyl]-4,5-dimethyl-2-oxo-7-phenyl-1H-pyrrolo[3,4-b]pyridine-3-carboxylate Traditional Name: 6-(4-chlorobenzyl)-2-keto-4,5-dimethyl-7-phenyl-1H-pyrrolo[3,4-b]pyridine-3-carboxylic acid ethyl ester Formula: C25H23ClN2O3 MolecularWeight: 434.91472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N(C(=C2NC1=O)C3=CC=CC=C3)CC4=CC=C(C=C4)Cl)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N(C(=C2NC1=O)C3=CC=CC=C3)CC4=CC=C(C=C4)Cl)C)C

InChI

InChI=1S/C25H23ClN2O3/c1-4-31-25(30)21-15(2)20-16(3)28(14-17-10-12-19(26)13-11-17)23(22(20)27-24(21)29)18-8-6-5-7-9-18/h5-13H,4,14H2,1-3H3,(H,27,29)