(3-chloranyl-4-oxidanyl-phenyl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4-oxidanyl-phenyl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(3-chloro-4-hydroxy-phenyl)methanone CAS Name: (3-chloro-4-hydroxyphenyl)-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(3-chloro-4-hydroxyphenyl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(3-chloro-4-hydroxy-phenyl)methanone Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=C(C=C2)O)Cl)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=C(C=C2)O)Cl)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H19ClN2O4S/c19-16-12-15(6-7-17(16)22)18(23)20-8-10-21(11-9-20)26(24,25)13-14-4-2-1-3-5-14/h1-7,12,22H,8-11,13H2