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

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]phthalazine-1-carboxylic acid Openeye Name: 3-[2-(isopropylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 4-oxo-3-[2-oxo-2-(propan-2-ylamino)ethyl]-1-phthalazinecarboxylic acid IUPAC Name: 4-oxo-3-[2-oxo-2-(propan-2-ylamino)ethyl]phthalazine-1-carboxylic acid Traditional Name: 3-[2-(isopropylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)O

Isomeric SMILES

CC(C)NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-8(2)15-11(18)7-17-13(19)10-6-4-3-5-9(10)12(16-17)14(20)21/h3-6,8H,7H2,1-2H3,(H,15,18)(H,20,21)