(1-ethylsulfonylpiperidin-4-yl)-phenethyl-(phenylmethyl)azanium

Systemtic Name: (1-ethylsulfonylpiperidin-4-yl)-phenethyl-(phenylmethyl)azanium Openeye Name: benzyl-(1-ethylsulfonyl-4-piperidyl)-phenethyl-ammonium CAS Name: (1-ethylsulfonyl-4-piperidinyl)-phenethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-(1-ethylsulfonylpiperidin-4-yl)-phenethylazanium Traditional Name: benzyl-(1-esyl-4-piperidyl)-phenethyl-ammonium Formula: C22H31N2O2S+ MolecularWeight: 387.55874

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2S/c1-2-27(25,26)24-17-14-22(15-18-24)23(19-21-11-7-4-8-12-21)16-13-20-9-5-3-6-10-20/h3-12,22H,2,13-19H2,1H3/p+1