[1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: [1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate Openeye Name: [2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] 3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-chlorophenyl)-1H-pyrazole-5-carboxylic acid [1-(cyclopentylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopentylamino)-1-oxopropan-2-yl] 3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-chlorophenyl)-1H-pyrazole-5-carboxylic acid [2-(cyclopentylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)OC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1CCCC1)OC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN3O3/c1-11(17(23)20-14-4-2-3-5-14)25-18(24)16-10-15(21-22-16)12-6-8-13(19)9-7-12/h6-11,14H,2-5H2,1H3,(H,20,23)(H,21,22)