methyl 2-(6-nitro-1H-4,1,2-benzoxadiazin-3-yl)benzoate

Systemtic Name: methyl 2-(6-nitro-1H-4,1,2-benzoxadiazin-3-yl)benzoate Openeye Name: methyl 2-(6-nitro-1H-4,1,2-benzoxadiazin-3-yl)benzoate CAS Name: 2-(6-nitro-1H-4,1,2-benzoxadiazin-3-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(6-nitro-1H-4,1,2-benzoxadiazin-3-yl)benzoate Traditional Name: 2-(6-nitro-1H-4,1,2-benzoxadiazin-3-yl)benzoic acid methyl ester Formula: C15H11N3O5 MolecularWeight: 313.26494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=NNC3=C(O2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=NNC3=C(O2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O5/c1-22-15(19)11-5-3-2-4-10(11)14-17-16-12-7-6-9(18(20)21)8-13(12)23-14/h2-8,16H,1H3