5,6-dimethyl-4-oxidanylidene-7-phenyl-1-(phenylmethyl)pyrrolo[3,4-b]pyridine-3-carboxylic acid

Systemtic Name: 5,6-dimethyl-4-oxidanylidene-7-phenyl-1-(phenylmethyl)pyrrolo[3,4-b]pyridine-3-carboxylic acid Openeye Name: 1-benzyl-5,6-dimethyl-4-oxo-7-phenyl-pyrrolo[3,4-b]pyridine-3-carboxylic acid CAS Name: 5,6-dimethyl-4-oxo-7-phenyl-1-(phenylmethyl)-3-pyrrolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-benzyl-5,6-dimethyl-4-oxo-7-phenylpyrrolo[3,4-b]pyridine-3-carboxylic acid Traditional Name: 1-benzyl-4-keto-5,6-dimethyl-7-phenyl-pyrrolo[3,4-b]pyridine-3-carboxylic acid Formula: C23H20N2O3 MolecularWeight: 372.4165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N1C)C3=CC=CC=C3)N(C=C(C2=O)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(N1C)C3=CC=CC=C3)N(C=C(C2=O)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O3/c1-15-19-21(20(24(15)2)17-11-7-4-8-12-17)25(13-16-9-5-3-6-10-16)14-18(22(19)26)23(27)28/h3-12,14H,13H2,1-2H3,(H,27,28)