4-oxidanylidene-3-[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl]phthalazine-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl]phthalazine-1-carboxylic acid Openeye Name: 3-[2-(N-isopropylanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 4-oxo-3-[2-oxo-2-(N-propan-2-ylanilino)ethyl]-1-phthalazinecarboxylic acid IUPAC Name: 4-oxo-3-[2-oxo-2-(N-propan-2-ylanilino)ethyl]phthalazine-1-carboxylic acid Traditional Name: 3-[2-(N-isopropylanilino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C20H19N3O4/c1-13(2)23(14-8-4-3-5-9-14)17(24)12-22-19(25)16-11-7-6-10-15(16)18(21-22)20(26)27/h3-11,13H,12H2,1-2H3,(H,26,27)