3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]butanoic acid

Systemtic Name: 3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]butanoic acid Openeye Name: 3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]butanoic acid CAS Name: 3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]butanoic acid IUPAC Name: 3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]butanoic acid Traditional Name: 3-[(4-keto-3H-phthalazine-1-carbonyl)amino]butyric acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C13H13N3O4/c1-7(6-10(17)18)14-13(20)11-8-4-2-3-5-9(8)12(19)16-15-11/h2-5,7H,6H2,1H3,(H,14,20)(H,16,19)(H,17,18)