ethyl 4-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H30ClN5O2 MolecularWeight: 431.9589

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H30ClN5O2/c1-2-30-22(29)28-12-10-27(11-13-28)20-4-3-9-26(16-20)15-18-14-24-25-21(18)17-5-7-19(23)8-6-17/h5-8,14,20H,2-4,9-13,15-16H2,1H3,(H,24,25)