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

Systemtic Name: (2R)-2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]pentanedioate Openeye Name: (2R)-2-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]pentanedioate CAS Name: (2R)-2-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]pentanedioate IUPAC Name: (2R)-2-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]pentanedioate Traditional Name: (2R)-2-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]glutarate Formula: C15H13N3O6-2 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H15N3O6/c1-18-14(22)9-5-3-2-4-8(9)12(17-18)13(21)16-10(15(23)24)6-7-11(19)20/h2-5,10H,6-7H2,1H3,(H,16,21)(H,19,20)(H,23,24)/p-2/t10-/m1/s1