2-[1-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]-4H-naphthalen-1-one hydrochloride

Systemtic Name: 2-[1-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]-4H-naphthalen-1-one hydrochloride Openeye Name: 2-[1-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]-4-piperidyl]-4H-naphthalen-1-one hydrochloride CAS Name: 2-[1-[2-(3,4-dimethylphenyl)-2-oxoethyl]-4-piperidinyl]-4H-naphthalen-1-one hydrochloride IUPAC Name: 2-[1-[2-(3,4-dimethylphenyl)-2-oxoethyl]piperidin-4-yl]-4H-naphthalen-1-one hydrochloride Traditional Name: 2-[1-[2-(3,4-dimethylphenyl)-2-keto-ethyl]-4-piperidyl]-4H-naphthalen-1-one hydrochloride Formula: C25H28ClNO2 MolecularWeight: 409.94832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CN2CCC(CC2)C3=CCC4=CC=CC=C4C3=O)C.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CN2CCC(CC2)C3=CCC4=CC=CC=C4C3=O)C.Cl

InChI

InChI=1S/C25H27NO2.ClH/c1-17-7-8-21(15-18(17)2)24(27)16-26-13-11-20(12-14-26)23-10-9-19-5-3-4-6-22(19)25(23)28;/h3-8,10,15,20H,9,11-14,16H2,1-2H3;1H