3-[[bis(azanyl)methylideneamino]methyl]benzoic acid

Systemtic Name: 3-[[bis(azanyl)methylideneamino]methyl]benzoic acid Openeye Name: 3-(guanidinomethyl)benzoic acid CAS Name: 3-[(diaminomethylideneamino)methyl]benzoic acid IUPAC Name: 3-[(diaminomethylideneamino)methyl]benzoic acid Traditional Name: 3-(guanidinomethyl)benzoic acid Formula: C9H11N3O2 MolecularWeight: 193.20254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN=C(N)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CN=C(N)N)C(=O)O

InChI

InChI=1S/C9H11N3O2/c10-9(11)12-5-6-2-1-3-7(4-6)8(13)14/h1-4H,5H2,(H,13,14)(H4,10,11,12)