(1-ethylsulfonylpiperidin-4-yl)-[(1S)-1-phenylpropyl]azanium

Systemtic Name: (1-ethylsulfonylpiperidin-4-yl)-[(1S)-1-phenylpropyl]azanium Openeye Name: (1-ethylsulfonyl-4-piperidyl)-[(1S)-1-phenylpropyl]ammonium CAS Name: (1-ethylsulfonyl-4-piperidinyl)-[(1S)-1-phenylpropyl]ammonium IUPAC Name: (1-ethylsulfonylpiperidin-4-yl)-[(1S)-1-phenylpropyl]azanium Traditional Name: (1-esyl-4-piperidyl)-[(1S)-1-phenylpropyl]ammonium Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)[NH2+]C2CCN(CC2)S(=O)(=O)CC

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)[NH2+]C2CCN(CC2)S(=O)(=O)CC

InChI

InChI=1S/C16H26N2O2S/c1-3-16(14-8-6-5-7-9-14)17-15-10-12-18(13-11-15)21(19,20)4-2/h5-9,15-17H,3-4,10-13H2,1-2H3/p+1/t16-/m0/s1