N-[3-(2-bromanylethanoyl)-4-oxidanylidene-6-phenoxy-chromen-7-yl]methanesulfonamide

Systemtic Name: N-[3-(2-bromanylethanoyl)-4-oxidanylidene-6-phenoxy-chromen-7-yl]methanesulfonamide Openeye Name: N-[3-(2-bromoacetyl)-4-oxo-6-phenoxy-chromen-7-yl]methanesulfonamide CAS Name: N-[3-(2-bromo-1-oxoethyl)-4-oxo-6-phenoxy-1-benzopyran-7-yl]methanesulfonamide IUPAC Name: N-[3-(2-bromoacetyl)-4-oxo-6-phenoxychromen-7-yl]methanesulfonamide Traditional Name: N-[3-(2-bromoacetyl)-4-keto-6-phenoxy-chromen-7-yl]methanesulfonamide Formula: C18H14BrNO6S MolecularWeight: 452.27586

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C2C(=C1)OC=C(C2=O)C(=O)CBr)OC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C2C(=C1)OC=C(C2=O)C(=O)CBr)OC3=CC=CC=C3

InChI

InChI=1S/C18H14BrNO6S/c1-27(23,24)20-14-8-16-12(18(22)13(10-25-16)15(21)9-19)7-17(14)26-11-5-3-2-4-6-11/h2-8,10,20H,9H2,1H3