2-[(1-naphthalen-1-ylsulfonylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline hydrochloride

Systemtic Name: 2-[(1-naphthalen-1-ylsulfonylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline hydrochloride Openeye Name: 2-[[1-(1-naphthylsulfonyl)-4-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline hydrochloride CAS Name: 2-[[1-(1-naphthalenylsulfonyl)-4-piperidinyl]methyl]-3,4-dihydro-1H-isoquinoline hydrochloride IUPAC Name: 2-[(1-naphthalen-1-ylsulfonylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline hydrochloride Traditional Name: 2-[[1-(1-naphthylsulfonyl)-4-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline hydrochloride Formula: C25H29ClN2O2S MolecularWeight: 457.02796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC=CC5=CC=CC=C54.Cl

Isomeric SMILES

C1CN(CCC1CN2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC=CC5=CC=CC=C54.Cl

InChI

InChI=1S/C25H28N2O2S.ClH/c28-30(29,25-11-5-9-22-7-3-4-10-24(22)25)27-16-12-20(13-17-27)18-26-15-14-21-6-1-2-8-23(21)19-26;/h1-11,20H,12-19H2;1H