dimethyl 1-(4-methylphenyl)carbonyl-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate

Systemtic Name: dimethyl 1-(4-methylphenyl)carbonyl-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate Openeye Name: dimethyl 4-benzyl-1-(4-methylbenzoyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate CAS Name: 1-[(4-methylphenyl)-oxomethyl]-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-benzyl-1-(4-methylbenzoyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate Traditional Name: 4-benzyl-1-p-toluoyl-pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylic acid dimethyl ester Formula: C29H24N2O5 MolecularWeight: 480.51126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C(=C3N2C4=CC=CC=C4N3CC5=CC=CC=C5)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C(=C3N2C4=CC=CC=C4N3CC5=CC=CC=C5)C(=O)OC)C(=O)OC

InChI

InChI=1S/C29H24N2O5/c1-18-13-15-20(16-14-18)26(32)25-23(28(33)35-2)24(29(34)36-3)27-30(17-19-9-5-4-6-10-19)21-11-7-8-12-22(21)31(25)27/h4-16H,17H2,1-3H3