[2-[1-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-[1-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-[1-(3-chlorophenyl)ethylamino]-2-oxo-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-[1-(3-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(3-chlorophenyl)ethylamino]-2-oxoethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-[1-(3-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Cl)NC(=O)COC(=O)C2=CN(N=C2)C

Isomeric SMILES

CC(C1=CC(=CC=C1)Cl)NC(=O)COC(=O)C2=CN(N=C2)C

InChI

InChI=1S/C15H16ClN3O3/c1-10(11-4-3-5-13(16)6-11)18-14(20)9-22-15(21)12-7-17-19(2)8-12/h3-8,10H,9H2,1-2H3,(H,18,20)