methyl 4-methyl-3-[2-[2-(phenylmethyl)benzimidazol-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[2-(phenylmethyl)benzimidazol-1-yl]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(2-benzylbenzimidazol-1-yl)acetyl]amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[2-(phenylmethyl)-1-benzimidazolyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-benzylbenzimidazol-1-yl)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(2-benzylbenzimidazol-1-yl)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C3=CC=CC=C3N=C2CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C3=CC=CC=C3N=C2CC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3/c1-17-12-13-19(25(30)31-2)15-21(17)27-24(29)16-28-22-11-7-6-10-20(22)26-23(28)14-18-8-4-3-5-9-18/h3-13,15H,14,16H2,1-2H3,(H,27,29)