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

Systemtic Name: [1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 3H-benzimidazole-5-carboxylate Openeye Name: 1-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]propyl 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid [1-(4-chloro-2-methoxy-5-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-chloro-2-methoxy-5-methylanilino)-1-oxobutan-2-yl] 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid 1-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]propyl ester Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O4/c1-4-17(19(25)24-16-7-11(2)13(21)9-18(16)27-3)28-20(26)12-5-6-14-15(8-12)23-10-22-14/h5-10,17H,4H2,1-3H3,(H,22,23)(H,24,25)