6-oxidanylidene-1-(2,2,3-trimethyl-6-nitro-3-oxidanyl-4H-chromen-4-yl)pyridine-3-carboxylic acid

Systemtic Name: 6-oxidanylidene-1-(2,2,3-trimethyl-6-nitro-3-oxidanyl-4H-chromen-4-yl)pyridine-3-carboxylic acid Openeye Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-chroman-4-yl)-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-4H-chromen-4-yl)-6-oxopyridine-3-carboxylic acid Traditional Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-chroman-4-yl)-6-keto-nicotinic acid Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C=C(C=CC3=O)C(=O)O)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C=C(C=CC3=O)C(=O)O)(C)O)C

InChI

InChI=1S/C18H18N2O7/c1-17(2)18(3,24)15(19-9-10(16(22)23)4-7-14(19)21)12-8-11(20(25)26)5-6-13(12)27-17/h4-9,15,24H,1-3H3,(H,22,23)