(1R)-2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol

Systemtic Name: (1R)-2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol Openeye Name: (1R)-2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]-1-phenyl-ethanol CAS Name: (1R)-2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]-1-phenylethanol IUPAC Name: (1R)-2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-1-phenylethanol Traditional Name: (1R)-2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]-1-phenyl-ethanol Formula: C16H20ClN2O3S2+ MolecularWeight: 387.9246

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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(S3)Cl

Isomeric SMILES

C1CN(CC[NH+]1C[C@@H](C2=CC=CC=C2)O)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H19ClN2O3S2/c17-15-6-7-16(23-15)24(21,22)19-10-8-18(9-11-19)12-14(20)13-4-2-1-3-5-13/h1-7,14,20H,8-12H2/p+1/t14-/m0/s1