(2-oxidanylidenecyclohexyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (2-oxidanylidenecyclohexyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-oxocyclohexyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (2-ketocyclohexyl) ester Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3CCCCC3=O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3CCCCC3=O

InChI

InChI=1S/C16H16N2O4/c1-18-15(20)11-7-3-2-6-10(11)14(17-18)16(21)22-13-9-5-4-8-12(13)19/h2-3,6-7,13H,4-5,8-9H2,1H3