1-(3-chloranyl-5-methyl-4-pentoxy-phenyl)-3-piperidin-1-yl-propan-1-one hydrochloride

Systemtic Name: 1-(3-chloranyl-5-methyl-4-pentoxy-phenyl)-3-piperidin-1-yl-propan-1-one hydrochloride Openeye Name: 1-(3-chloro-5-methyl-4-pentoxy-phenyl)-3-(1-piperidyl)propan-1-one hydrochloride CAS Name: 1-(3-chloro-5-methyl-4-pentoxyphenyl)-3-(1-piperidinyl)-1-propanone hydrochloride IUPAC Name: 1-(3-chloro-5-methyl-4-pentoxyphenyl)-3-piperidin-1-ylpropan-1-one hydrochloride Traditional Name: 1-(4-amoxy-3-chloro-5-methyl-phenyl)-3-piperidino-propan-1-one hydrochloride Formula: C20H31Cl2NO2 MolecularWeight: 388.37164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Cl)C(=O)CCN2CCCCC2)C.Cl

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Cl)C(=O)CCN2CCCCC2)C.Cl

InChI

InChI=1S/C20H30ClNO2.ClH/c1-3-4-8-13-24-20-16(2)14-17(15-18(20)21)19(23)9-12-22-10-6-5-7-11-22;/h14-15H,3-13H2,1-2H3;1H