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

Systemtic Name: (3-methyl-2-oxidanyl-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(2-hydroxy-3-methyl-phenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(2-hydroxy-3-methylphenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(2-hydroxy-3-methylphenyl)methanone Traditional Name: (4-besylpiperazino)-(2-hydroxy-3-methyl-phenyl)methanone Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

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