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

Systemtic Name: ethyl 1-(2-chlorophenyl)-5-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-chlorophenyl)-5-[[3-(2-oxopyrrolidin-1-yl)propylamino]methyl]pyrazole-4-carboxylate CAS Name: 1-(2-chlorophenyl)-5-[[3-(2-oxo-1-pyrrolidinyl)propylamino]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chlorophenyl)-5-[[3-(2-oxopyrrolidin-1-yl)propylamino]methyl]pyrazole-4-carboxylate Traditional Name: 1-(2-chlorophenyl)-5-[[3-(2-ketopyrrolidino)propylamino]methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C20H25ClN4O3 MolecularWeight: 404.8905

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2Cl)CNCCCN3CCCC3=O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2Cl)CNCCCN3CCCC3=O

InChI

InChI=1S/C20H25ClN4O3/c1-2-28-20(27)15-13-23-25(17-8-4-3-7-16(17)21)18(15)14-22-10-6-12-24-11-5-9-19(24)26/h3-4,7-8,13,22H,2,5-6,9-12,14H2,1H3