ethyl 4-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate

Systemtic Name: ethyl 4-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate Openeye Name: ethyl 4-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)butanoate CAS Name: 4-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)butanoate Traditional Name: 4-(3-keto-6-nitro-1,4-benzoxazin-4-yl)butyric acid ethyl ester Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O6/c1-2-21-14(18)4-3-7-15-11-8-10(16(19)20)5-6-12(11)22-9-13(15)17/h5-6,8H,2-4,7,9H2,1H3