5,5-dimethyl-3-(6-methyl-5-nitro-pyridin-2-yl)oxy-4-(4-methylsulfonylphenyl)furan-2-one

Systemtic Name: 5,5-dimethyl-3-(6-methyl-5-nitro-pyridin-2-yl)oxy-4-(4-methylsulfonylphenyl)furan-2-one Openeye Name: 5,5-dimethyl-3-[(6-methyl-5-nitro-2-pyridyl)oxy]-4-(4-methylsulfonylphenyl)furan-2-one CAS Name: 5,5-dimethyl-3-[(6-methyl-5-nitro-2-pyridinyl)oxy]-4-(4-methylsulfonylphenyl)-2-furanone IUPAC Name: 5,5-dimethyl-3-(6-methyl-5-nitropyridin-2-yl)oxy-4-(4-methylsulfonylphenyl)furan-2-one Traditional Name: 4-(4-mesylphenyl)-5,5-dimethyl-3-[(6-methyl-5-nitro-2-pyridyl)oxy]furan-2-one Formula: C19H18N2O7S MolecularWeight: 418.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)OC2=C(C(OC2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=N1)OC2=C(C(OC2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O7S/c1-11-14(21(23)24)9-10-15(20-11)27-17-16(19(2,3)28-18(17)22)12-5-7-13(8-6-12)29(4,25)26/h5-10H,1-4H3