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

Systemtic Name: 1-[3-ethyl-4-(4-pentoxybutoxy)phenyl]-3-piperidin-1-yl-propan-1-one hydrochloride Openeye Name: 1-[3-ethyl-4-(4-pentoxybutoxy)phenyl]-3-(1-piperidyl)propan-1-one hydrochloride CAS Name: 1-[3-ethyl-4-(4-pentoxybutoxy)phenyl]-3-(1-piperidinyl)-1-propanone hydrochloride IUPAC Name: 1-[3-ethyl-4-(4-pentoxybutoxy)phenyl]-3-piperidin-1-ylpropan-1-one hydrochloride Traditional Name: 1-[4-(4-amoxybutoxy)-3-ethyl-phenyl]-3-piperidino-propan-1-one hydrochloride Formula: C25H42ClNO3 MolecularWeight: 440.05888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCCCCOC1=C(C=C(C=C1)C(=O)CCN2CCCCC2)CC.Cl

Isomeric SMILES

CCCCCOCCCCOC1=C(C=C(C=C1)C(=O)CCN2CCCCC2)CC.Cl

InChI

InChI=1S/C25H41NO3.ClH/c1-3-5-9-18-28-19-10-11-20-29-25-13-12-23(21-22(25)4-2)24(27)14-17-26-15-7-6-8-16-26;/h12-13,21H,3-11,14-20H2,1-2H3;1H