[2-oxidanylidene-2-(propylamino)ethyl] 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Openeye Name: [2-oxo-2-(propylamino)ethyl] 5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxylic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Traditional Name: 5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxylic acid [2-keto-2-(propylamino)ethyl] ester Formula: C18H22ClN3O3 MolecularWeight: 363.83858

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=C(N(N=C1C)CC2=CC=C(C=C2)C)Cl

Isomeric SMILES

CCCNC(=O)COC(=O)C1=C(N(N=C1C)CC2=CC=C(C=C2)C)Cl

InChI

InChI=1S/C18H22ClN3O3/c1-4-9-20-15(23)11-25-18(24)16-13(3)21-22(17(16)19)10-14-7-5-12(2)6-8-14/h5-8H,4,9-11H2,1-3H3,(H,20,23)