ethyl 5-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-2-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[4-(3-chlorobenzyl)piperazine-1-carbonyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C19H23ClN4O3 MolecularWeight: 390.86392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H23ClN4O3/c1-3-27-19(26)17-12-16(21-22(17)2)18(25)24-9-7-23(8-10-24)13-14-5-4-6-15(20)11-14/h4-6,11-12H,3,7-10,13H2,1-2H3