1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-[4-(phenylmethyl)piperidin-1-yl]propan-2-ol hydrochloride

Systemtic Name: 1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-[4-(phenylmethyl)piperidin-1-yl]propan-2-ol hydrochloride Openeye Name: 1-(4-allyl-2-methoxy-phenoxy)-3-(4-benzyl-1-piperidyl)propan-2-ol hydrochloride CAS Name: 1-(2-methoxy-4-prop-2-enylphenoxy)-3-[4-(phenylmethyl)-1-piperidinyl]-2-propanol hydrochloride IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(2-methoxy-4-prop-2-enylphenoxy)propan-2-ol hydrochloride Traditional Name: 1-(4-allyl-2-methoxy-phenoxy)-3-(4-benzylpiperidino)propan-2-ol hydrochloride Formula: C25H34ClNO3 MolecularWeight: 431.99536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(CN2CCC(CC2)CC3=CC=CC=C3)O.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(CN2CCC(CC2)CC3=CC=CC=C3)O.Cl

InChI

InChI=1S/C25H33NO3.ClH/c1-3-7-20-10-11-24(25(17-20)28-2)29-19-23(27)18-26-14-12-22(13-15-26)16-21-8-5-4-6-9-21;/h3-6,8-11,17,22-23,27H,1,7,12-16,18-19H2,2H3;1H