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

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Openeye Name: [2-(butylamino)-2-oxo-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-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 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-(butylamino)-2-keto-ethyl] ester Formula: C19H24ClN3O3 MolecularWeight: 377.86516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24ClN3O3/c1-4-5-10-21-16(24)12-26-19(25)17-14(3)22-23(18(17)20)11-15-8-6-13(2)7-9-15/h6-9H,4-5,10-12H2,1-3H3,(H,21,24)