2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(4-chlorophenyl)carbonylpiperidine-1-carboxylate

Systemtic Name: 2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(4-chlorophenyl)carbonylpiperidine-1-carboxylate Openeye Name: 2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(4-chlorobenzoyl)piperidine-1-carboxylate CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-1-piperidinecarboxylic acid 2-(3,5-diphenyl-1-pyrazolyl)ethyl ester IUPAC Name: 2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(4-chlorobenzoyl)piperidine-1-carboxylate Traditional Name: 4-(4-chlorobenzoyl)piperidine-1-carboxylic acid 2-(3,5-diphenylpyrazol-1-yl)ethyl ester Formula: C30H28ClN3O3 MolecularWeight: 514.01462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)Cl)C(=O)OCCN3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)Cl)C(=O)OCCN3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H28ClN3O3/c31-26-13-11-24(12-14-26)29(35)25-15-17-33(18-16-25)30(36)37-20-19-34-28(23-9-5-2-6-10-23)21-27(32-34)22-7-3-1-4-8-22/h1-14,21,25H,15-20H2