methyl (2R)-4-methyl-2-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]pentanoate Openeye Name: methyl (2R)-4-methyl-2-[(4-oxo-3H-phthalazine-1-carbonyl)amino]pentanoate CAS Name: (2R)-4-methyl-2-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-4-methyl-2-[(4-oxo-3H-phthalazine-1-carbonyl)amino]pentanoate Traditional Name: (2R)-2-[(4-keto-3H-phthalazine-1-carbonyl)amino]-4-methyl-valeric acid methyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C16H19N3O4/c1-9(2)8-12(16(22)23-3)17-15(21)13-10-6-4-5-7-11(10)14(20)19-18-13/h4-7,9,12H,8H2,1-3H3,(H,17,21)(H,19,20)/t12-/m1/s1