[5-[3-[(4-chlorophenyl)methyl]-3-methyl-piperidin-1-yl]sulfonylnaphthalen-1-yl]-dimethyl-azanium

Systemtic Name: [5-[3-[(4-chlorophenyl)methyl]-3-methyl-piperidin-1-yl]sulfonylnaphthalen-1-yl]-dimethyl-azanium Openeye Name: [5-[[3-[(4-chlorophenyl)methyl]-3-methyl-1-piperidyl]sulfonyl]-1-naphthyl]-dimethyl-ammonium CAS Name: [5-[[3-[(4-chlorophenyl)methyl]-3-methyl-1-piperidinyl]sulfonyl]-1-naphthalenyl]-dimethylammonium IUPAC Name: [5-[3-[(4-chlorophenyl)methyl]-3-methylpiperidin-1-yl]sulfonylnaphthalen-1-yl]-dimethylazanium Traditional Name: [5-[3-(4-chlorobenzyl)-3-methyl-piperidino]sulfonyl-1-naphthyl]-dimethyl-ammonium Formula: C25H30ClN2O2S+ MolecularWeight: 458.0359

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3[NH+](C)C)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1(CCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3[NH+](C)C)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H29ClN2O2S/c1-25(17-19-11-13-20(26)14-12-19)15-6-16-28(18-25)31(29,30)24-10-5-7-21-22(24)8-4-9-23(21)27(2)3/h4-5,7-14H,6,15-18H2,1-3H3/p+1