N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4-methylpiperidin-1-yl)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4-methylpiperidin-1-yl)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-(4-methyl-1-piperidyl)-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-(4-methyl-1-piperidinyl)-1,4-dioxo-2-naphthalenesulfonamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-(4-methylpiperidin-1-yl)-1,4-dioxonaphthalene-2-sulfonamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1,4-diketo-3-(4-methylpiperidino)naphthalene-2-sulfonamide Formula: C22H20BrFN2O4S MolecularWeight: 507.372603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C22H20BrFN2O4S/c1-13-8-10-26(11-9-13)19-20(27)15-4-2-3-5-16(15)21(28)22(19)31(29,30)25-18-7-6-14(23)12-17(18)24/h2-7,12-13,25H,8-11H2,1H3