2-[[4-(nitrooxymethyl)phenyl]carbonylamino]-5-oxidanylidene-7-propan-2-yl-chromeno[2,3-b]pyridine-3-carboxylic acid

Systemtic Name: 2-[[4-(nitrooxymethyl)phenyl]carbonylamino]-5-oxidanylidene-7-propan-2-yl-chromeno[2,3-b]pyridine-3-carboxylic acid Openeye Name: 7-isopropyl-2-[[4-(nitrooxymethyl)benzoyl]amino]-5-oxo-chromeno[2,3-b]pyridine-3-carboxylic acid CAS Name: 2-[[[4-(nitrooxymethyl)phenyl]-oxomethyl]amino]-5-oxo-7-propan-2-yl-3-[1]benzopyrano[2,3-b]pyridinecarboxylic acid IUPAC Name: 2-[[4-(nitrooxymethyl)benzoyl]amino]-5-oxo-7-propan-2-ylchromeno[2,3-b]pyridine-3-carboxylic acid Traditional Name: 7-isopropyl-5-keto-2-[[4-(nitrooxymethyl)benzoyl]amino]chromeno[2,3-b]pyridine-3-carboxylic acid Formula: C24H19N3O8 MolecularWeight: 477.42296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC3=NC(=C(C=C3C2=O)C(=O)O)NC(=O)C4=CC=C(C=C4)CO[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC3=NC(=C(C=C3C2=O)C(=O)O)NC(=O)C4=CC=C(C=C4)CO[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O8/c1-12(2)15-7-8-19-16(9-15)20(28)17-10-18(24(30)31)21(26-23(17)35-19)25-22(29)14-5-3-13(4-6-14)11-34-27(32)33/h3-10,12H,11H2,1-2H3,(H,30,31)(H,25,26,29)