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

Systemtic Name: 4-acetamido-3-[bis(azanyl)methylideneamino]-5-(2-hydroxyethyl)benzoic acid Openeye Name: 4-acetamido-3-guanidino-5-(2-hydroxyethyl)benzoic acid CAS Name: 4-acetamido-3-(diaminomethylideneamino)-5-(2-hydroxyethyl)benzoic acid IUPAC Name: 4-acetamido-3-(diaminomethylideneamino)-5-(2-hydroxyethyl)benzoic acid Traditional Name: 4-acetamido-3-guanidino-5-(2-hydroxyethyl)benzoic acid Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1N=C(N)N)C(=O)O)CCO

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1N=C(N)N)C(=O)O)CCO

InChI

InChI=1S/C12H16N4O4/c1-6(18)15-10-7(2-3-17)4-8(11(19)20)5-9(10)16-12(13)14/h4-5,17H,2-3H2,1H3,(H,15,18)(H,19,20)(H4,13,14,16)