[(3S)-2-oxidanylideneoxolan-3-yl] 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C14H12N2O8 MolecularWeight: 336.25368

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC(=O)[C@H]1OC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O8/c17-12-7-23-10-2-1-8(16(20)21)5-9(10)15(12)6-13(18)24-11-3-4-22-14(11)19/h1-2,5,11H,3-4,6-7H2/t11-/m0/s1