methyl 1-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)benzimidazole-5-carboxylate

Systemtic Name: methyl 1-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)benzimidazole-5-carboxylate Openeye Name: methyl 1-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)benzimidazole-5-carboxylate CAS Name: 1-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)benzimidazole-5-carboxylate Traditional Name: 1-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)benzimidazole-5-carboxylic acid methyl ester Formula: C24H21N3O5 MolecularWeight: 431.44064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)C(=O)OC)N=C2C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)C(=O)OC)N=C2C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O5/c1-31-20-10-3-16(4-11-20)13-14-26-22-12-7-18(24(28)32-2)15-21(22)25-23(26)17-5-8-19(9-6-17)27(29)30/h3-12,15H,13-14H2,1-2H3