1,2-dimethyl-7-oxidanylidene-3-(phenylcarbonyl)-4-(phenylmethyl)pyrrolo[3,2-b]pyridine-6-carboxylic acid

Systemtic Name: 1,2-dimethyl-7-oxidanylidene-3-(phenylcarbonyl)-4-(phenylmethyl)pyrrolo[3,2-b]pyridine-6-carboxylic acid Openeye Name: 3-benzoyl-4-benzyl-1,2-dimethyl-7-oxo-pyrrolo[3,2-b]pyridine-6-carboxylic acid CAS Name: 3-benzoyl-1,2-dimethyl-7-oxo-4-(phenylmethyl)-6-pyrrolo[3,2-b]pyridinecarboxylic acid IUPAC Name: 3-benzoyl-4-benzyl-1,2-dimethyl-7-oxopyrrolo[3,2-b]pyridine-6-carboxylic acid Traditional Name: 3-benzoyl-4-benzyl-7-keto-1,2-dimethyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid Formula: C24H20N2O4 MolecularWeight: 400.4266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C(=O)C(=CN2CC3=CC=CC=C3)C(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1C)C(=O)C(=CN2CC3=CC=CC=C3)C(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O4/c1-15-19(22(27)17-11-7-4-8-12-17)20-21(25(15)2)23(28)18(24(29)30)14-26(20)13-16-9-5-3-6-10-16/h3-12,14H,13H2,1-2H3,(H,29,30)