4-[bis(azanyl)methylideneamino]-3-nitro-benzoic acid

Systemtic Name: 4-[bis(azanyl)methylideneamino]-3-nitro-benzoic acid Openeye Name: 4-guanidino-3-nitro-benzoic acid CAS Name: 4-(diaminomethylideneamino)-3-nitrobenzoic acid IUPAC Name: 4-(diaminomethylideneamino)-3-nitrobenzoic acid Traditional Name: 4-guanidino-3-nitro-benzoic acid Formula: C8H8N4O4 MolecularWeight: 224.17352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N=C(N)N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N=C(N)N

InChI

InChI=1S/C8H8N4O4/c9-8(10)11-5-2-1-4(7(13)14)3-6(5)12(15)16/h1-3H,(H,13,14)(H4,9,10,11)