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

Systemtic Name: dimethyl 1-(4-bromophenyl)carbonyl-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate Openeye Name: dimethyl 4-benzyl-1-(4-bromobenzoyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate CAS Name: 1-[(4-bromophenyl)-oxomethyl]-4-(phenylmethyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-benzyl-1-(4-bromobenzoyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylate Traditional Name: 4-benzyl-1-(4-bromobenzoyl)pyrrolo[1,2-a]benzimidazole-2,3-dicarboxylic acid dimethyl ester Formula: C28H21BrN2O5 MolecularWeight: 545.38074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N2C3=CC=CC=C3N(C2=C1C(=O)OC)CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

COC(=O)C1=C(N2C3=CC=CC=C3N(C2=C1C(=O)OC)CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H21BrN2O5/c1-35-27(33)22-23(28(34)36-2)26-30(16-17-8-4-3-5-9-17)20-10-6-7-11-21(20)31(26)24(22)25(32)18-12-14-19(29)15-13-18/h3-15H,16H2,1-2H3