4-azanyl-3-[bis(azanyl)methylideneamino]-5-(2-hydroxyethyl)benzoic acid

Systemtic Name: 4-azanyl-3-[bis(azanyl)methylideneamino]-5-(2-hydroxyethyl)benzoic acid Openeye Name: 4-amino-3-guanidino-5-(2-hydroxyethyl)benzoic acid CAS Name: 4-amino-3-(diaminomethylideneamino)-5-(2-hydroxyethyl)benzoic acid IUPAC Name: 4-amino-3-(diaminomethylideneamino)-5-(2-hydroxyethyl)benzoic acid Traditional Name: 4-amino-3-guanidino-5-(2-hydroxyethyl)benzoic acid Formula: C10H14N4O3 MolecularWeight: 238.24316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1CCO)N)N=C(N)N)C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1CCO)N)N=C(N)N)C(=O)O

InChI

InChI=1S/C10H14N4O3/c11-8-5(1-2-15)3-6(9(16)17)4-7(8)14-10(12)13/h3-4,15H,1-2,11H2,(H,16,17)(H4,12,13,14)