4,4-dimethyl-2-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]pentanoic acid

Systemtic Name: 4,4-dimethyl-2-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]pentanoic acid Openeye Name: 4,4-dimethyl-2-[(4-oxo-3H-phthalazin-1-yl)amino]pentanoic acid CAS Name: 4,4-dimethyl-2-[(4-oxo-3H-phthalazin-1-yl)amino]pentanoic acid IUPAC Name: 4,4-dimethyl-2-[(4-oxo-3H-phthalazin-1-yl)amino]pentanoic acid Traditional Name: 2-[(4-keto-3H-phthalazin-1-yl)amino]-4,4-dimethyl-valeric acid Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)O)NC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C)(C)CC(C(=O)O)NC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C15H19N3O3/c1-15(2,3)8-11(14(20)21)16-12-9-6-4-5-7-10(9)13(19)18-17-12/h4-7,11H,8H2,1-3H3,(H,16,17)(H,18,19)(H,20,21)