ethyl 2-(3,6-dinitro-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate

Systemtic Name: ethyl 2-(3,6-dinitro-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate Openeye Name: ethyl 2-(7-hydroxy-3,6-dinitro-2-oxo-chromen-4-yl)acetate CAS Name: 2-(7-hydroxy-3,6-dinitro-2-oxo-1-benzopyran-4-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(7-hydroxy-3,6-dinitro-2-oxochromen-4-yl)acetate Traditional Name: 2-(7-hydroxy-2-keto-3,6-dinitro-chromen-4-yl)acetic acid ethyl ester Formula: C13H10N2O9 MolecularWeight: 338.2265

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=O)OC2=CC(=C(C=C21)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=C(C(=O)OC2=CC(=C(C=C21)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O9/c1-2-23-11(17)4-7-6-3-8(14(19)20)9(16)5-10(6)24-13(18)12(7)15(21)22/h3,5,16H,2,4H2,1H3