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

Systemtic Name: 2,2-dimethyl-3-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylamino]-3-phenyl-propanoic acid Openeye Name: 2,2-dimethyl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylamino]-3-phenyl-propanoic acid CAS Name: 2,2-dimethyl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylamino]-3-phenylpropanoic acid IUPAC Name: 2,2-dimethyl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylamino]-3-phenylpropanoic acid Traditional Name: 3-[3-[(4-keto-3H-phthalazin-1-yl)amino]propylamino]-2,2-dimethyl-3-phenyl-propionic acid Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC=CC=C1)NCCCNC2=NNC(=O)C3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)(C(C1=CC=CC=C1)NCCCNC2=NNC(=O)C3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C22H26N4O3/c1-22(2,21(28)29)18(15-9-4-3-5-10-15)23-13-8-14-24-19-16-11-6-7-12-17(16)20(27)26-25-19/h3-7,9-12,18,23H,8,13-14H2,1-2H3,(H,24,25)(H,26,27)(H,28,29)