3,8-dimethyl-6-nitro-2H-1,3-benzoxazin-3-ium

Systemtic Name: 3,8-dimethyl-6-nitro-2H-1,3-benzoxazin-3-ium Openeye Name: 3,8-dimethyl-6-nitro-2H-1,3-benzoxazin-3-ium CAS Name: 3,8-dimethyl-6-nitro-2H-1,3-benzoxazin-3-ium IUPAC Name: 3,8-dimethyl-6-nitro-2H-1,3-benzoxazin-3-ium Traditional Name: 3,8-dimethyl-6-nitro-2H-1,3-benzoxazin-3-ium Formula: C10H11N2O3+ MolecularWeight: 207.20594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)[N+](=O)[O-])C=[N+](CO2)C

Isomeric SMILES

CC1=C2C(=CC(=C1)[N+](=O)[O-])C=[N+](CO2)C

InChI

InChI=1S/C10H11N2O3/c1-7-3-9(12(13)14)4-8-5-11(2)6-15-10(7)8/h3-5H,6H2,1-2H3/q+1