4-[bis(azanyl)methylidenecarbamoylamino]benzoic acid

Systemtic Name: 4-[bis(azanyl)methylidenecarbamoylamino]benzoic acid Openeye Name: 4-(diaminomethylenecarbamoylamino)benzoic acid CAS Name: 4-[[(diaminomethylideneamino)-oxomethyl]amino]benzoic acid IUPAC Name: 4-(diaminomethylidenecarbamoylamino)benzoic acid Traditional Name: 4-(diaminomethylenecarbamoylamino)benzoic acid Formula: C9H10N4O3 MolecularWeight: 222.2007

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)N=C(N)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)N=C(N)N

InChI

InChI=1S/C9H10N4O3/c10-8(11)13-9(16)12-6-3-1-5(2-4-6)7(14)15/h1-4H,(H,14,15)(H5,10,11,12,13,16)