4-ethyl-1-[1-(1-ethylsulfonylpiperidin-4-yl)propyl]-1-phenyl-piperidin-1-ium

Systemtic Name: 4-ethyl-1-[1-(1-ethylsulfonylpiperidin-4-yl)propyl]-1-phenyl-piperidin-1-ium Openeye Name: 4-ethyl-1-[1-(1-ethylsulfonyl-4-piperidyl)propyl]-1-phenyl-piperidin-1-ium CAS Name: 4-ethyl-1-[1-(1-ethylsulfonyl-4-piperidinyl)propyl]-1-phenylpiperidin-1-ium IUPAC Name: 4-ethyl-1-[1-(1-ethylsulfonylpiperidin-4-yl)propyl]-1-phenylpiperidin-1-ium Traditional Name: 1-[1-(1-esyl-4-piperidyl)propyl]-4-ethyl-1-phenyl-piperidin-1-ium Formula: C23H39N2O2S+ MolecularWeight: 407.63296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC[N+](CC1)(C2=CC=CC=C2)C(CC)C3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCC1CC[N+](CC1)(C2=CC=CC=C2)C(CC)C3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C23H39N2O2S/c1-4-20-14-18-25(19-15-20,22-10-8-7-9-11-22)23(5-2)21-12-16-24(17-13-21)28(26,27)6-3/h7-11,20-21,23H,4-6,12-19H2,1-3H3/q+1