methyl 4-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate

Systemtic Name: methyl 4-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate Openeye Name: methyl 4-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate CAS Name: 4-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate Traditional Name: 4-[(5,7-dinitrobenzofurazan-4-yl)amino]benzoic acid methyl ester Formula: C14H9N5O7 MolecularWeight: 359.25056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O7/c1-25-14(20)7-2-4-8(5-3-7)15-11-9(18(21)22)6-10(19(23)24)12-13(11)17-26-16-12/h2-6,15H,1H3