ethyl 4-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl-methylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C26H29ClN4O3 MolecularWeight: 480.98646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H29ClN4O3/c1-3-34-26(33)30-15-13-20(14-16-30)25(32)29(2)17-21-18-31(23-7-5-4-6-8-23)28-24(21)19-9-11-22(27)12-10-19/h4-12,18,20H,3,13-17H2,1-2H3