[3-(2-nitrooxyethyl)-4-oxidanylidene-2H-1,3-benzoxazin-7-yl] ethanoate

Systemtic Name: [3-(2-nitrooxyethyl)-4-oxidanylidene-2H-1,3-benzoxazin-7-yl] ethanoate Openeye Name: [3-(2-nitrooxyethyl)-4-oxo-2H-1,3-benzoxazin-7-yl] acetate CAS Name: acetic acid [3-(2-nitrooxyethyl)-4-oxo-2H-1,3-benzoxazin-7-yl] ester IUPAC Name: [3-(2-nitrooxyethyl)-4-oxo-2H-1,3-benzoxazin-7-yl] acetate Traditional Name: acetic acid [4-keto-3-(2-nitrooxyethyl)-2H-1,3-benzoxazin-7-yl] ester Formula: C12H12N2O7 MolecularWeight: 296.23288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C(=O)N(CO2)CCO[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C(=O)N(CO2)CCO[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O7/c1-8(15)21-9-2-3-10-11(6-9)19-7-13(12(10)16)4-5-20-14(17)18/h2-3,6H,4-5,7H2,1H3