(2S)-3-oxidanyl-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]propanoate

Systemtic Name: (2S)-3-oxidanyl-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]propanoate Openeye Name: (2S)-3-hydroxy-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]propionate Formula: C13H12N3O5- MolecularWeight: 290.25148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C13H13N3O5/c17-6-10(13(20)21)14-11(18)5-9-7-3-1-2-4-8(7)12(19)16-15-9/h1-4,10,17H,5-6H2,(H,14,18)(H,16,19)(H,20,21)/p-1/t10-/m0/s1