ethyl 6,7-dimethyl-1-(4-methylphenyl)carbonyl-2-phenyl-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 6,7-dimethyl-1-(4-methylphenyl)carbonyl-2-phenyl-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-benzyl-6,7-dimethyl-1-(4-methylbenzoyl)-2-phenyl-pyrrolo[1,2-a]benzimidazole-3-carboxylate CAS Name: 6,7-dimethyl-1-[(4-methylphenyl)-oxomethyl]-2-phenyl-4-(phenylmethyl)-3-pyrrolo[1,2-a]benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-6,7-dimethyl-1-(4-methylbenzoyl)-2-phenylpyrrolo[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-benzyl-6,7-dimethyl-2-phenyl-1-p-toluoyl-pyrrolo[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C36H32N2O3 MolecularWeight: 540.65088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N(C3=C(N2C(=C1C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C)C=C(C(=C3)C)C)CC6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C2N(C3=C(N2C(=C1C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C)C=C(C(=C3)C)C)CC6=CC=CC=C6

InChI

InChI=1S/C36H32N2O3/c1-5-41-36(40)32-31(27-14-10-7-11-15-27)33(34(39)28-18-16-23(2)17-19-28)38-30-21-25(4)24(3)20-29(30)37(35(32)38)22-26-12-8-6-9-13-26/h6-21H,5,22H2,1-4H3