1-[2,2-dimethyl-3-oxidanyl-6-(phenylsulfonyl)-3,4-dihydrochromen-4-yl]-5-nitro-pyridin-2-one

Systemtic Name: 1-[2,2-dimethyl-3-oxidanyl-6-(phenylsulfonyl)-3,4-dihydrochromen-4-yl]-5-nitro-pyridin-2-one Openeye Name: 1-[6-(benzenesulfonyl)-3-hydroxy-2,2-dimethyl-chroman-4-yl]-5-nitro-pyridin-2-one CAS Name: 1-[6-(benzenesulfonyl)-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-5-nitro-2-pyridinone IUPAC Name: 1-[6-(benzenesulfonyl)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-5-nitropyridin-2-one Traditional Name: 1-(6-besyl-3-hydroxy-2,2-dimethyl-chroman-4-yl)-5-nitro-2-pyridone Formula: C22H20N2O7S MolecularWeight: 456.4684

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N4C=C(C=CC4=O)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N4C=C(C=CC4=O)[N+](=O)[O-])O)C

InChI

InChI=1S/C22H20N2O7S/c1-22(2)21(26)20(23-13-14(24(27)28)8-11-19(23)25)17-12-16(9-10-18(17)31-22)32(29,30)15-6-4-3-5-7-15/h3-13,20-21,26H,1-2H3