[1-[(3-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate

Systemtic Name: [1-[(3-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate Openeye Name: 1-[(3-chloro-2-methyl-phenyl)carbamoyl]propyl 2-(1H-benzimidazol-2-yl)benzoate CAS Name: 2-(1H-benzimidazol-2-yl)benzoic acid [1-(3-chloro-2-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3-chloro-2-methylanilino)-1-oxobutan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate Traditional Name: 2-(1H-benzimidazol-2-yl)benzoic acid 1-[(3-chloro-2-methyl-phenyl)carbamoyl]propyl ester Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CC=C1)Cl)C)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC(C(=O)NC1=C(C(=CC=C1)Cl)C)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C25H22ClN3O3/c1-3-22(24(30)29-19-14-8-11-18(26)15(19)2)32-25(31)17-10-5-4-9-16(17)23-27-20-12-6-7-13-21(20)28-23/h4-14,22H,3H2,1-2H3,(H,27,28)(H,29,30)