2-azanyl-4-(2-azanyl-3-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid dihydrate

Systemtic Name: 2-azanyl-4-(2-azanyl-3-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid dihydrate Openeye Name: 2-amino-4-(2-amino-3-hydroxy-phenyl)-4-oxo-butanoic acid dihydrate CAS Name: 2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid dihydrate IUPAC Name: 2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid dihydrate Traditional Name: 2-amino-4-(2-amino-3-hydroxy-phenyl)-4-keto-butyric acid dihydrate Formula: C10H16N2O6 MolecularWeight: 260.24384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O4.2H2O/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12;;/h1-3,6,13H,4,11-12H2,(H,15,16);2*1H2