[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-(3-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-(3-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-(3-chlorophenyl)-5-methyl-triazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-5-methyl-4-triazolecarboxylic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-(3-chlorophenyl)-5-methyltriazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-5-methyl-triazole-4-carboxylic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C17H21ClN4O3 MolecularWeight: 364.82664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCC(=O)NCCC(C)C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=NN(N=C1C(=O)OCC(=O)NCCC(C)C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H21ClN4O3/c1-11(2)7-8-19-15(23)10-25-17(24)16-12(3)20-22(21-16)14-6-4-5-13(18)9-14/h4-6,9,11H,7-8,10H2,1-3H3,(H,19,23)