4-[5-[(4-butoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]piperidine

Systemtic Name: 4-[5-[(4-butoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]piperidine Openeye Name: 4-[5-[(4-butoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]piperidine CAS Name: 4-[5-[(4-butoxyphenyl)methyl]-2-ethyl-3-pyrazolyl]piperidine IUPAC Name: 4-[5-[(4-butoxyphenyl)methyl]-2-ethylpyrazol-3-yl]piperidine Traditional Name: 4-[5-(4-butoxybenzyl)-2-ethyl-pyrazol-3-yl]piperidine Formula: C21H31N3O MolecularWeight: 341.49034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC2=NN(C(=C2)C3CCNCC3)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC2=NN(C(=C2)C3CCNCC3)CC

InChI

InChI=1S/C21H31N3O/c1-3-5-14-25-20-8-6-17(7-9-20)15-19-16-21(24(4-2)23-19)18-10-12-22-13-11-18/h6-9,16,18,22H,3-5,10-15H2,1-2H3