1-[5-chloranyl-2-(phenylmethyl)sulfonyl-phenyl]-2-piperazin-1-yl-ethanol

Systemtic Name: 1-[5-chloranyl-2-(phenylmethyl)sulfonyl-phenyl]-2-piperazin-1-yl-ethanol Openeye Name: 1-(2-benzylsulfonyl-5-chloro-phenyl)-2-piperazin-1-yl-ethanol CAS Name: 1-[5-chloro-2-(phenylmethyl)sulfonylphenyl]-2-(1-piperazinyl)ethanol IUPAC Name: 1-(2-benzylsulfonyl-5-chlorophenyl)-2-piperazin-1-ylethanol Traditional Name: 1-(2-benzylsulfonyl-5-chloro-phenyl)-2-piperazino-ethanol Formula: C19H23ClN2O3S MolecularWeight: 394.91552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(C2=C(C=CC(=C2)Cl)S(=O)(=O)CC3=CC=CC=C3)O

Isomeric SMILES

C1CN(CCN1)CC(C2=C(C=CC(=C2)Cl)S(=O)(=O)CC3=CC=CC=C3)O

InChI

InChI=1S/C19H23ClN2O3S/c20-16-6-7-19(26(24,25)14-15-4-2-1-3-5-15)17(12-16)18(23)13-22-10-8-21-9-11-22/h1-7,12,18,21,23H,8-11,13-14H2