[1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-(o-tolylcarbamoyl)propyl 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid [1-(2-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxobutan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid 1-(o-tolylcarbamoyl)propyl ester Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H25N3O4/c1-4-23(25(30)29-20-8-6-5-7-16(20)2)33-26(31)18-11-14-21-22(15-18)28-24(27-21)17-9-12-19(32-3)13-10-17/h5-15,23H,4H2,1-3H3,(H,27,28)(H,29,30)