(2S)-3-(4-hydroxyphenyl)-2-[(2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonylamino]propanoate

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-[(2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonylamino]propanoate Openeye Name: (2S)-3-(4-hydroxyphenyl)-2-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[oxo-(2-oxo-1,3-dihydroimidazol-4-yl)methyl]amino]propanoate IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[(2-keto-4-imidazoline-4-carbonyl)amino]propionate Formula: C13H12N3O5- MolecularWeight: 290.25148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)[O-])NC(=O)C2=CNC(=O)N2)O

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)[O-])NC(=O)C2=CNC(=O)N2)O

InChI

InChI=1S/C13H13N3O5/c17-8-3-1-7(2-4-8)5-9(12(19)20)15-11(18)10-6-14-13(21)16-10/h1-4,6,9,17H,5H2,(H,15,18)(H,19,20)(H2,14,16,21)/p-1/t9-/m0/s1