6-nitro-5-propyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-nitro-5-propyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-nitro-5-propyl-4H-1,4-benzoxazin-3-one CAS Name: 6-nitro-5-propyl-4H-1,4-benzoxazin-3-one IUPAC Name: 6-nitro-5-propyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-nitro-5-propyl-4H-1,4-benzoxazin-3-one Formula: C11H12N2O4 MolecularWeight: 236.22398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1NC(=O)CO2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C=CC2=C1NC(=O)CO2)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O4/c1-2-3-7-8(13(15)16)4-5-9-11(7)12-10(14)6-17-9/h4-5H,2-3,6H2,1H3,(H,12,14)