ethyl 4-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[(1-methyl-3-phenyl-4-pyrazolyl)methyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(1-methyl-3-phenylpyrazol-4-yl)methyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CN(N=C3C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CN(N=C3C4=CC=CC=C4)C

InChI

InChI=1S/C23H33N5O2/c1-3-30-23(29)28-14-12-27(13-15-28)21-10-7-11-26(18-21)17-20-16-25(2)24-22(20)19-8-5-4-6-9-19/h4-6,8-9,16,21H,3,7,10-15,17-18H2,1-2H3