methyl 2-[2-(2-chloranylethanoylcarbamoyl)-3-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-phenyl-phenyl]-1H-benzimidazole-4-carboxylate

Systemtic Name: methyl 2-[2-(2-chloranylethanoylcarbamoyl)-3-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-phenyl-phenyl]-1H-benzimidazole-4-carboxylate Openeye Name: methyl 2-[2-[(2-chloroacetyl)carbamoyl]-3-[(2-ethoxy-2-oxo-ethyl)amino]-4-phenyl-phenyl]-1H-benzimidazole-4-carboxylate CAS Name: 2-[2-[[(2-chloro-1-oxoethyl)amino]-oxomethyl]-3-[(2-ethoxy-2-oxoethyl)amino]-4-phenylphenyl]-1H-benzimidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-[(2-chloroacetyl)carbamoyl]-3-[(2-ethoxy-2-oxoethyl)amino]-4-phenylphenyl]-1H-benzimidazole-4-carboxylate Traditional Name: 2-[2-[(2-chloroacetyl)carbamoyl]-3-[(2-ethoxy-2-keto-ethyl)amino]-4-phenyl-phenyl]-1H-benzimidazole-4-carboxylic acid methyl ester Formula: C28H25ClN4O6 MolecularWeight: 548.9743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=C(C=CC(=C1C(=O)NC(=O)CCl)C2=NC3=C(C=CC=C3N2)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CNC1=C(C=CC(=C1C(=O)NC(=O)CCl)C2=NC3=C(C=CC=C3N2)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H25ClN4O6/c1-3-39-22(35)15-30-25-17(16-8-5-4-6-9-16)12-13-18(23(25)27(36)32-21(34)14-29)26-31-20-11-7-10-19(24(20)33-26)28(37)38-2/h4-13,30H,3,14-15H2,1-2H3,(H,31,33)(H,32,34,36)