6-cyano-5-methyl-7-oxidanyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxylic acid

Systemtic Name: 6-cyano-5-methyl-7-oxidanyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxylic acid Openeye Name: 6-cyano-7-hydroxy-5-methyl-4-oxo-3-phenyl-phthalazine-1-carboxylic acid CAS Name: 6-cyano-7-hydroxy-5-methyl-4-oxo-3-phenyl-1-phthalazinecarboxylic acid IUPAC Name: 6-cyano-7-hydroxy-5-methyl-4-oxo-3-phenylphthalazine-1-carboxylic acid Traditional Name: 6-cyano-7-hydroxy-4-keto-5-methyl-3-phenyl-phthalazine-1-carboxylic acid Formula: C17H11N3O4 MolecularWeight: 321.28694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1C#N)O)C(=NN(C2=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1C#N)O)C(=NN(C2=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H11N3O4/c1-9-12(8-18)13(21)7-11-14(9)16(22)20(19-15(11)17(23)24)10-5-3-2-4-6-10/h2-7,21H,1H3,(H,23,24)