5-methyl-8-nitro-4H-1,4-benzoxazin-3-one

Systemtic Name: 5-methyl-8-nitro-4H-1,4-benzoxazin-3-one Openeye Name: 5-methyl-8-nitro-4H-1,4-benzoxazin-3-one CAS Name: 5-methyl-8-nitro-4H-1,4-benzoxazin-3-one IUPAC Name: 5-methyl-8-nitro-4H-1,4-benzoxazin-3-one Traditional Name: 5-methyl-8-nitro-4H-1,4-benzoxazin-3-one Formula: C9H8N2O4 MolecularWeight: 208.17082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)[N+](=O)[O-])OCC(=O)N2

Isomeric SMILES

CC1=C2C(=C(C=C1)[N+](=O)[O-])OCC(=O)N2

InChI

InChI=1S/C9H8N2O4/c1-5-2-3-6(11(13)14)9-8(5)10-7(12)4-15-9/h2-3H,4H2,1H3,(H,10,12)