N-(3-nitro-2-oxidanyl-4-oxidanylidene-6-phenoxy-chromen-7-yl)methanesulfonamide

Systemtic Name: N-(3-nitro-2-oxidanyl-4-oxidanylidene-6-phenoxy-chromen-7-yl)methanesulfonamide Openeye Name: N-(2-hydroxy-3-nitro-4-oxo-6-phenoxy-chromen-7-yl)methanesulfonamide CAS Name: N-(2-hydroxy-3-nitro-4-oxo-6-phenoxy-1-benzopyran-7-yl)methanesulfonamide IUPAC Name: N-(2-hydroxy-3-nitro-4-oxo-6-phenoxychromen-7-yl)methanesulfonamide Traditional Name: N-(2-hydroxy-4-keto-3-nitro-6-phenoxy-chromen-7-yl)methanesulfonamide Formula: C16H12N2O8S MolecularWeight: 392.34008

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C2C(=C1)OC(=C(C2=O)[N+](=O)[O-])O)OC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C2C(=C1)OC(=C(C2=O)[N+](=O)[O-])O)OC3=CC=CC=C3

InChI

InChI=1S/C16H12N2O8S/c1-27(23,24)17-11-8-12-10(15(19)14(18(21)22)16(20)26-12)7-13(11)25-9-5-3-2-4-6-9/h2-8,17,20H,1H3