3,5-diphenyl-6-(3-piperidin-1-ylpropanoyl)cyclohex-2-en-1-one hydrochloride

Systemtic Name: 3,5-diphenyl-6-(3-piperidin-1-ylpropanoyl)cyclohex-2-en-1-one hydrochloride Openeye Name: 3,5-diphenyl-6-[3-(1-piperidyl)propanoyl]cyclohex-2-en-1-one hydrochloride CAS Name: 6-[1-oxo-3-(1-piperidinyl)propyl]-3,5-diphenyl-1-cyclohex-2-enone hydrochloride IUPAC Name: 3,5-diphenyl-6-(3-piperidin-1-ylpropanoyl)cyclohex-2-en-1-one hydrochloride Traditional Name: 3,5-diphenyl-6-(3-piperidinopropanoyl)cyclohex-2-en-1-one hydrochloride Formula: C26H30ClNO2 MolecularWeight: 423.9749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(=O)C2C(CC(=CC2=O)C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CCN(CC1)CCC(=O)C2C(CC(=CC2=O)C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H29NO2.ClH/c28-24(14-17-27-15-8-3-9-16-27)26-23(21-12-6-2-7-13-21)18-22(19-25(26)29)20-10-4-1-5-11-20;/h1-2,4-7,10-13,19,23,26H,3,8-9,14-18H2;1H