4-[4-[(4-chloranylnaphthalen-1-yl)methyl]piperidin-1-yl]-1-phenyl-butan-1-one hydrochloride

Systemtic Name: 4-[4-[(4-chloranylnaphthalen-1-yl)methyl]piperidin-1-yl]-1-phenyl-butan-1-one hydrochloride Openeye Name: 4-[4-[(4-chloro-1-naphthyl)methyl]-1-piperidyl]-1-phenyl-butan-1-one hydrochloride CAS Name: 4-[4-[(4-chloro-1-naphthalenyl)methyl]-1-piperidinyl]-1-phenyl-1-butanone hydrochloride IUPAC Name: 4-[4-[(4-chloronaphthalen-1-yl)methyl]piperidin-1-yl]-1-phenylbutan-1-one hydrochloride Traditional Name: 4-[4-[(4-chloro-1-naphthyl)methyl]piperidino]-1-phenyl-butan-1-one hydrochloride Formula: C26H29Cl2NO MolecularWeight: 442.42056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=C(C3=CC=CC=C23)Cl)CCCC(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=C(C3=CC=CC=C23)Cl)CCCC(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H28ClNO.ClH/c27-25-13-12-22(23-9-4-5-10-24(23)25)19-20-14-17-28(18-15-20)16-6-11-26(29)21-7-2-1-3-8-21;/h1-5,7-10,12-13,20H,6,11,14-19H2;1H