4-(cyclopropylmethylsulfonyl)-6-methyl-3-nitro-2-oxidanylidene-pyridine-1-carboxylic acid

Systemtic Name: 4-(cyclopropylmethylsulfonyl)-6-methyl-3-nitro-2-oxidanylidene-pyridine-1-carboxylic acid Openeye Name: 4-(cyclopropylmethylsulfonyl)-6-methyl-3-nitro-2-oxo-pyridine-1-carboxylic acid CAS Name: 4-(cyclopropylmethylsulfonyl)-6-methyl-3-nitro-2-oxo-1-pyridinecarboxylic acid IUPAC Name: 4-(cyclopropylmethylsulfonyl)-6-methyl-3-nitro-2-oxopyridine-1-carboxylic acid Traditional Name: 4-(cyclopropylmethylsulfonyl)-2-keto-6-methyl-3-nitro-pyridine-1-carboxylic acid Formula: C11H12N2O7S MolecularWeight: 316.28718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1C(=O)O)[N+](=O)[O-])S(=O)(=O)CC2CC2

Isomeric SMILES

CC1=CC(=C(C(=O)N1C(=O)O)[N+](=O)[O-])S(=O)(=O)CC2CC2

InChI

InChI=1S/C11H12N2O7S/c1-6-4-8(21(19,20)5-7-2-3-7)9(13(17)18)10(14)12(6)11(15)16/h4,7H,2-3,5H2,1H3,(H,15,16)