4-[methyl-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]amino]butanoic acid Openeye Name: 4-[methyl-(4-oxo-3H-phthalazine-1-carbonyl)amino]butanoic acid CAS Name: 4-[methyl-[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]butanoic acid IUPAC Name: 4-[methyl-(4-oxo-3H-phthalazine-1-carbonyl)amino]butanoic acid Traditional Name: 4-[(4-keto-3H-phthalazine-1-carbonyl)-methyl-amino]butyric acid Formula: C14H15N3O4 MolecularWeight: 289.2866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H15N3O4/c1-17(8-4-7-11(18)19)14(21)12-9-5-2-3-6-10(9)13(20)16-15-12/h2-3,5-6H,4,7-8H2,1H3,(H,16,20)(H,18,19)