8-chloranyl-9-nitro-4-oxidanylidene-5-propyl-1,5-dihydrochromeno[4,3-b]pyridine-2-carboxylic acid

Systemtic Name: 8-chloranyl-9-nitro-4-oxidanylidene-5-propyl-1,5-dihydrochromeno[4,3-b]pyridine-2-carboxylic acid Openeye Name: 8-chloro-9-nitro-4-oxo-5-propyl-1,5-dihydrochromeno[4,3-b]pyridine-2-carboxylic acid CAS Name: 8-chloro-9-nitro-4-oxo-5-propyl-1,5-dihydro[1]benzopyrano[4,3-b]pyridine-2-carboxylic acid IUPAC Name: 8-chloro-9-nitro-4-oxo-5-propyl-1,5-dihydrochromeno[4,3-b]pyridine-2-carboxylic acid Traditional Name: 8-chloro-4-keto-9-nitro-5-propyl-1,5-dihydrochromeno[4,3-b]pyridine-2-carboxylic acid Formula: C16H13ClN2O6 MolecularWeight: 364.73722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=C(C3=CC(=C(C=C3O1)Cl)[N+](=O)[O-])NC(=CC2=O)C(=O)O

Isomeric SMILES

CCCC1C2=C(C3=CC(=C(C=C3O1)Cl)[N+](=O)[O-])NC(=CC2=O)C(=O)O

InChI

InChI=1S/C16H13ClN2O6/c1-2-3-12-14-11(20)6-9(16(21)22)18-15(14)7-4-10(19(23)24)8(17)5-13(7)25-12/h4-6,12H,2-3H2,1H3,(H,18,20)(H,21,22)