(phenylmethyl) 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate Openeye Name: benzyl 4-oxo-3-pentyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-pentyl-1-phthalazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-oxo-3-pentylphthalazine-1-carboxylate Traditional Name: 3-amyl-4-keto-phthalazine-1-carboxylic acid benzyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3/c1-2-3-9-14-23-20(24)18-13-8-7-12-17(18)19(22-23)21(25)26-15-16-10-5-4-6-11-16/h4-8,10-13H,2-3,9,14-15H2,1H3