(1-ethylsulfonylpiperidin-4-yl)-[(1R)-1-(2-methylphenyl)ethyl]azanium

Systemtic Name: (1-ethylsulfonylpiperidin-4-yl)-[(1R)-1-(2-methylphenyl)ethyl]azanium Openeye Name: (1-ethylsulfonyl-4-piperidyl)-[(1R)-1-(o-tolyl)ethyl]ammonium CAS Name: (1-ethylsulfonyl-4-piperidinyl)-[(1R)-1-(2-methylphenyl)ethyl]ammonium IUPAC Name: (1-ethylsulfonylpiperidin-4-yl)-[(1R)-1-(2-methylphenyl)ethyl]azanium Traditional Name: (1-esyl-4-piperidyl)-[(1R)-1-(o-tolyl)ethyl]ammonium Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)[NH2+]C(C)C2=CC=CC=C2C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)[NH2+][C@H](C)C2=CC=CC=C2C

InChI

InChI=1S/C16H26N2O2S/c1-4-21(19,20)18-11-9-15(10-12-18)17-14(3)16-8-6-5-7-13(16)2/h5-8,14-15,17H,4,9-12H2,1-3H3/p+1/t14-/m1/s1