4-(methylamino)-3,5-dinitro-benzoic acid

Systemtic Name: 4-(methylamino)-3,5-dinitro-benzoic acid Openeye Name: 4-(methylamino)-3,5-dinitro-benzoic acid CAS Name: 4-(methylamino)-3,5-dinitrobenzoic acid IUPAC Name: 4-(methylamino)-3,5-dinitrobenzoic acid Traditional Name: 4-(methylamino)-3,5-dinitro-benzoic acid Formula: C8H7N3O6 MolecularWeight: 241.15768

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H7N3O6/c1-9-7-5(10(14)15)2-4(8(12)13)3-6(7)11(16)17/h2-3,9H,1H3,(H,12,13)