ethyl 1-[2-[5-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[2-[5-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[2-oxo-2-[3-phenyl-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]ethyl]piperidine-2-carboxylate CAS Name: 1-[2-[5-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[5-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]piperidine-2-carboxylate Traditional Name: 1-[2-keto-2-[5-phenyl-3-(p-tolyl)-2-pyrazolin-1-yl]ethyl]pipecolinic acid ethyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1CC(=O)N2C(CC(=N2)C3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCCN1CC(=O)N2C(CC(=N2)C3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O3/c1-3-32-26(31)23-11-7-8-16-28(23)18-25(30)29-24(21-9-5-4-6-10-21)17-22(27-29)20-14-12-19(2)13-15-20/h4-6,9-10,12-15,23-24H,3,7-8,11,16-18H2,1-2H3