[1-[(3-chloranyl-4-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(3-chloranyl-4-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 3H-benzimidazole-5-carboxylate Openeye Name: 1-[(3-chloro-4-methyl-phenyl)carbamoyl]propyl 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid [1-(3-chloro-4-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3-chloro-4-methylanilino)-1-oxobutan-2-yl] 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid 1-[(3-chloro-4-methyl-phenyl)carbamoyl]propyl ester Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)C)Cl)OC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)C)Cl)OC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C19H18ClN3O3/c1-3-17(18(24)23-13-6-4-11(2)14(20)9-13)26-19(25)12-5-7-15-16(8-12)22-10-21-15/h4-10,17H,3H2,1-2H3,(H,21,22)(H,23,24)