ethyl 6-nitro-5-oxidanyl-4-oxidanylidene-8-propyl-chromene-2-carboxylate

Systemtic Name: ethyl 6-nitro-5-oxidanyl-4-oxidanylidene-8-propyl-chromene-2-carboxylate Openeye Name: ethyl 5-hydroxy-6-nitro-4-oxo-8-propyl-chromene-2-carboxylate CAS Name: 5-hydroxy-6-nitro-4-oxo-8-propyl-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-6-nitro-4-oxo-8-propylchromene-2-carboxylate Traditional Name: 5-hydroxy-4-keto-6-nitro-8-propyl-chromene-2-carboxylic acid ethyl ester Formula: C15H15NO7 MolecularWeight: 321.2821

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C2=C1OC(=CC2=O)C(=O)OCC)O)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=C(C2=C1OC(=CC2=O)C(=O)OCC)O)[N+](=O)[O-]

InChI

InChI=1S/C15H15NO7/c1-3-5-8-6-9(16(20)21)13(18)12-10(17)7-11(23-14(8)12)15(19)22-4-2/h6-7,18H,3-5H2,1-2H3