1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-4-(phenylmethyl)piperazine chloride

Systemtic Name: 1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-4-(phenylmethyl)piperazine chloride Openeye Name: 1-benzyl-4-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-piperazine chloride CAS Name: 1-(4-chloro-2,5-dimethylphenyl)sulfonyl-4-(phenylmethyl)piperazine chloride IUPAC Name: 1-benzyl-4-(4-chloro-2,5-dimethylphenyl)sulfonylpiperazine chloride Traditional Name: 1-benzyl-4-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-piperazine chloride Formula: C19H23Cl2N2O2S- MolecularWeight: 414.36912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C19H23ClN2O2S.ClH/c1-15-13-19(16(2)12-18(15)20)25(23,24)22-10-8-21(9-11-22)14-17-6-4-3-5-7-17;/h3-7,12-13H,8-11,14H2,1-2H3;1H/p-1