[4-nitro-2-(oxan-4-yloxy)phenyl]methanesulfonamide

Systemtic Name: [4-nitro-2-(oxan-4-yloxy)phenyl]methanesulfonamide Openeye Name: (4-nitro-2-tetrahydropyran-4-yloxy-phenyl)methanesulfonamide CAS Name: [4-nitro-2-(4-oxanyloxy)phenyl]methanesulfonamide IUPAC Name: [4-nitro-2-(oxan-4-yloxy)phenyl]methanesulfonamide Traditional Name: (4-nitro-2-tetrahydropyran-4-yloxy-phenyl)methanesulfonamide Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=C(C=CC(=C2)[N+](=O)[O-])CS(=O)(=O)N

Isomeric SMILES

C1COCCC1OC2=C(C=CC(=C2)[N+](=O)[O-])CS(=O)(=O)N

InChI

InChI=1S/C12H16N2O6S/c13-21(17,18)8-9-1-2-10(14(15)16)7-12(9)20-11-3-5-19-6-4-11/h1-2,7,11H,3-6,8H2,(H2,13,17,18)