1-[4-(4-ethoxybutoxy)-3-ethyl-phenyl]-3-piperidin-1-yl-propan-1-one hydrochloride

Systemtic Name: 1-[4-(4-ethoxybutoxy)-3-ethyl-phenyl]-3-piperidin-1-yl-propan-1-one hydrochloride Openeye Name: 1-[4-(4-ethoxybutoxy)-3-ethyl-phenyl]-3-(1-piperidyl)propan-1-one hydrochloride CAS Name: 1-[4-(4-ethoxybutoxy)-3-ethylphenyl]-3-(1-piperidinyl)-1-propanone hydrochloride IUPAC Name: 1-[4-(4-ethoxybutoxy)-3-ethylphenyl]-3-piperidin-1-ylpropan-1-one hydrochloride Traditional Name: 1-[4-(4-ethoxybutoxy)-3-ethyl-phenyl]-3-piperidino-propan-1-one hydrochloride Formula: C22H36ClNO3 MolecularWeight: 397.97914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C(=O)CCN2CCCCC2)OCCCCOCC.Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)C(=O)CCN2CCCCC2)OCCCCOCC.Cl

InChI

InChI=1S/C22H35NO3.ClH/c1-3-19-18-20(21(24)12-15-23-13-6-5-7-14-23)10-11-22(19)26-17-9-8-16-25-4-2;/h10-11,18H,3-9,12-17H2,1-2H3;1H