(1R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol

Systemtic Name: (1R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol Openeye Name: (1R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol CAS Name: (1R)-2-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-phenylethanol IUPAC Name: (1R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenylethanol Traditional Name: (1R)-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol Formula: C18H21Cl2N2O3S+ MolecularWeight: 416.34194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20Cl2N2O3S/c19-16-7-6-15(12-17(16)20)26(24,25)22-10-8-21(9-11-22)13-18(23)14-4-2-1-3-5-14/h1-7,12,18,23H,8-11,13H2/p+1/t18-/m0/s1