7-fluoranyl-4-(2-methylpropyl)-2-nitro-1,4-benzoxazin-3-one

Systemtic Name: 7-fluoranyl-4-(2-methylpropyl)-2-nitro-1,4-benzoxazin-3-one Openeye Name: 7-fluoro-4-isobutyl-2-nitro-1,4-benzoxazin-3-one CAS Name: 7-fluoro-4-(2-methylpropyl)-2-nitro-1,4-benzoxazin-3-one IUPAC Name: 7-fluoro-4-(2-methylpropyl)-2-nitro-1,4-benzoxazin-3-one Traditional Name: 7-fluoro-4-isobutyl-2-nitro-1,4-benzoxazin-3-one Formula: C12H13FN2O4 MolecularWeight: 268.241023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)F)OC(C1=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)F)OC(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C12H13FN2O4/c1-7(2)6-14-9-4-3-8(13)5-10(9)19-12(11(14)16)15(17)18/h3-5,7,12H,6H2,1-2H3