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

Systemtic Name: ethyl 6,7-dimethyl-1-(3-nitrophenyl)carbonyl-2-phenyl-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-benzyl-6,7-dimethyl-1-(3-nitrobenzoyl)-2-phenyl-pyrrolo[1,2-a]benzimidazole-3-carboxylate CAS Name: 6,7-dimethyl-1-[(3-nitrophenyl)-oxomethyl]-2-phenyl-4-(phenylmethyl)-3-pyrrolo[1,2-a]benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-6,7-dimethyl-1-(3-nitrobenzoyl)-2-phenylpyrrolo[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-benzyl-6,7-dimethyl-1-(3-nitrobenzoyl)-2-phenyl-pyrrolo[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C35H29N3O5 MolecularWeight: 571.62186

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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(=CC=C5)[N+](=O)[O-])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(=CC=C5)[N+](=O)[O-])C=C(C(=C3)C)C)CC6=CC=CC=C6

InChI

InChI=1S/C35H29N3O5/c1-4-43-35(40)31-30(25-14-9-6-10-15-25)32(33(39)26-16-11-17-27(20-26)38(41)42)37-29-19-23(3)22(2)18-28(29)36(34(31)37)21-24-12-7-5-8-13-24/h5-20H,4,21H2,1-3H3