(1S)-1-phenyl-2-[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]ethanol

Systemtic Name: (1S)-1-phenyl-2-[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]ethanol Openeye Name: (1S)-2-(4-benzylsulfonylpiperazin-1-ium-1-yl)-1-phenyl-ethanol CAS Name: (1S)-1-phenyl-2-[4-(phenylmethyl)sulfonyl-1-piperazin-1-iumyl]ethanol IUPAC Name: (1S)-2-(4-benzylsulfonylpiperazin-1-ium-1-yl)-1-phenylethanol Traditional Name: (1S)-2-(4-benzylsulfonylpiperazin-1-ium-1-yl)-1-phenyl-ethanol Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(C2=CC=CC=C2)O)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](C2=CC=CC=C2)O)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O3S/c22-19(18-9-5-2-6-10-18)15-20-11-13-21(14-12-20)25(23,24)16-17-7-3-1-4-8-17/h1-10,19,22H,11-16H2/p+1/t19-/m1/s1