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

Systemtic Name: 5-methyl-4-oxidanylidene-7-phenyl-1,6-bis(phenylmethyl)pyrrolo[3,4-b]pyridine-3-carboxylic acid Openeye Name: 1,6-dibenzyl-5-methyl-4-oxo-7-phenyl-pyrrolo[3,4-b]pyridine-3-carboxylic acid CAS Name: 5-methyl-4-oxo-7-phenyl-1,6-bis(phenylmethyl)-3-pyrrolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1,6-dibenzyl-5-methyl-4-oxo-7-phenylpyrrolo[3,4-b]pyridine-3-carboxylic acid Traditional Name: 1,6-dibenzyl-4-keto-5-methyl-7-phenyl-pyrrolo[3,4-b]pyridine-3-carboxylic acid Formula: C29H24N2O3 MolecularWeight: 448.51246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N1CC3=CC=CC=C3)C4=CC=CC=C4)N(C=C(C2=O)C(=O)O)CC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=C(N1CC3=CC=CC=C3)C4=CC=CC=C4)N(C=C(C2=O)C(=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O3/c1-20-25-27(30(17-21-11-5-2-6-12-21)19-24(28(25)32)29(33)34)26(23-15-9-4-10-16-23)31(20)18-22-13-7-3-8-14-22/h2-16,19H,17-18H2,1H3,(H,33,34)