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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-morpholin-4-yl-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-morpholino-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-(4-morpholinyl)-1,4-dioxo-2-naphthalenesulfonamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-morpholin-4-yl-1,4-dioxonaphthalene-2-sulfonamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1,4-diketo-3-morpholino-naphthalene-2-sulfonamide Formula: C20H16BrFN2O5S MolecularWeight: 495.318843

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1COCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H16BrFN2O5S/c21-12-5-6-16(15(22)11-12)23-30(27,28)20-17(24-7-9-29-10-8-24)18(25)13-3-1-2-4-14(13)19(20)26/h1-6,11,23H,7-10H2