(3-fluoranyl-4-methoxy-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: (4-besylpiperazino)-(3-fluoro-4-methoxy-phenyl)methanone Formula: C18H19FN2O4S MolecularWeight: 378.417863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)F

InChI

InChI=1S/C18H19FN2O4S/c1-25-17-8-7-14(13-16(17)19)18(22)20-9-11-21(12-10-20)26(23,24)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3