1,5-dimethyl-4-[(3-methylpiperidin-1-yl)methyl]-2-phenyl-pyrazol-3-one hydrochloride

Systemtic Name: 1,5-dimethyl-4-[(3-methylpiperidin-1-yl)methyl]-2-phenyl-pyrazol-3-one hydrochloride Openeye Name: 1,5-dimethyl-4-[(3-methyl-1-piperidyl)methyl]-2-phenyl-pyrazol-3-one hydrochloride CAS Name: 1,5-dimethyl-4-[(3-methyl-1-piperidinyl)methyl]-2-phenyl-3-pyrazolone hydrochloride IUPAC Name: 1,5-dimethyl-4-[(3-methylpiperidin-1-yl)methyl]-2-phenylpyrazol-3-one hydrochloride Traditional Name: 1,5-dimethyl-4-[(3-methylpiperidino)methyl]-2-phenyl-3-pyrazolin-3-one hydrochloride Formula: C18H26ClN3O MolecularWeight: 335.87154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=C(N(N(C2=O)C3=CC=CC=C3)C)C.Cl

Isomeric SMILES

CC1CCCN(C1)CC2=C(N(N(C2=O)C3=CC=CC=C3)C)C.Cl

InChI

InChI=1S/C18H25N3O.ClH/c1-14-8-7-11-20(12-14)13-17-15(2)19(3)21(18(17)22)16-9-5-4-6-10-16;/h4-6,9-10,14H,7-8,11-13H2,1-3H3;1H