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

Systemtic Name: 6-ethyl-5-methyl-4-oxidanylidene-7-phenyl-1-(phenylmethyl)pyrrolo[3,4-b]pyridine-3-carboxylic acid Openeye Name: 1-benzyl-6-ethyl-5-methyl-4-oxo-7-phenyl-pyrrolo[3,4-b]pyridine-3-carboxylic acid CAS Name: 6-ethyl-5-methyl-4-oxo-7-phenyl-1-(phenylmethyl)-3-pyrrolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-benzyl-6-ethyl-5-methyl-4-oxo-7-phenylpyrrolo[3,4-b]pyridine-3-carboxylic acid Traditional Name: 1-benzyl-6-ethyl-4-keto-5-methyl-7-phenyl-pyrrolo[3,4-b]pyridine-3-carboxylic acid Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C(=C1C3=CC=CC=C3)N(C=C(C2=O)C(=O)O)CC4=CC=CC=C4)C

Isomeric SMILES

CCN1C(=C2C(=C1C3=CC=CC=C3)N(C=C(C2=O)C(=O)O)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H22N2O3/c1-3-26-16(2)20-22(21(26)18-12-8-5-9-13-18)25(14-17-10-6-4-7-11-17)15-19(23(20)27)24(28)29/h4-13,15H,3,14H2,1-2H3,(H,28,29)