2-methyl-7-oxidanylidene-1,4-bis(phenylmethyl)pyrrolo[3,2-b]pyridine-3,6-dicarboxylic acid

Systemtic Name: 2-methyl-7-oxidanylidene-1,4-bis(phenylmethyl)pyrrolo[3,2-b]pyridine-3,6-dicarboxylic acid Openeye Name: 1,4-dibenzyl-2-methyl-7-oxo-pyrrolo[3,2-b]pyridine-3,6-dicarboxylic acid CAS Name: 2-methyl-7-oxo-1,4-bis(phenylmethyl)pyrrolo[3,2-b]pyridine-3,6-dicarboxylic acid IUPAC Name: 1,4-dibenzyl-2-methyl-7-oxopyrrolo[3,2-b]pyridine-3,6-dicarboxylic acid Traditional Name: 1,4-dibenzyl-7-keto-2-methyl-pyrrolo[3,2-b]pyridine-3,6-dicarboxylic acid Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C(=O)C(=CN2CC4=CC=CC=C4)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C(=O)C(=CN2CC4=CC=CC=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C24H20N2O5/c1-15-19(24(30)31)20-21(26(15)13-17-10-6-3-7-11-17)22(27)18(23(28)29)14-25(20)12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3,(H,28,29)(H,30,31)