3,5-dinitro-4-phenylazanyl-benzoic acid

Systemtic Name: 3,5-dinitro-4-phenylazanyl-benzoic acid Openeye Name: 4-anilino-3,5-dinitro-benzoic acid CAS Name: 4-anilino-3,5-dinitrobenzoic acid IUPAC Name: 4-anilino-3,5-dinitrobenzoic acid Traditional Name: 4-anilino-3,5-dinitro-benzoic acid Formula: C13H9N3O6 MolecularWeight: 303.22706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O6/c17-13(18)8-6-10(15(19)20)12(11(7-8)16(21)22)14-9-4-2-1-3-5-9/h1-7,14H,(H,17,18)