(5-methyl-2-oxidanyl-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (5-methyl-2-oxidanyl-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(2-hydroxy-5-methyl-phenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(2-hydroxy-5-methylphenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(2-hydroxy-5-methylphenyl)methanone Traditional Name: (4-besylpiperazino)-(2-hydroxy-5-methyl-phenyl)methanone Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O4S/c1-14-7-8-17(21)16(13-14)18(22)19-9-11-20(12-10-19)25(23,24)15-5-3-2-4-6-15/h2-8,13,21H,9-12H2,1H3