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

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]phthalazine-1-carboxylic acid Openeye Name: 3-[2-(2-isopropylanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 4-oxo-3-[2-oxo-2-(2-propan-2-ylanilino)ethyl]-1-phthalazinecarboxylic acid IUPAC Name: 4-oxo-3-[2-oxo-2-(2-propan-2-ylanilino)ethyl]phthalazine-1-carboxylic acid Traditional Name: 3-[2-(2-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)C1=CC=CC=C1NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

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