propyl 4-(4-oxidanylidene-3H-phthalazin-1-yl)benzoate

Systemtic Name: propyl 4-(4-oxidanylidene-3H-phthalazin-1-yl)benzoate Openeye Name: propyl 4-(4-oxo-3H-phthalazin-1-yl)benzoate CAS Name: 4-(4-oxo-3H-phthalazin-1-yl)benzoic acid propyl ester IUPAC Name: propyl 4-(4-oxo-3H-phthalazin-1-yl)benzoate Traditional Name: 4-(4-keto-3H-phthalazin-1-yl)benzoic acid propyl ester Formula: C18H16N2O3 MolecularWeight: 308.33124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H16N2O3/c1-2-11-23-18(22)13-9-7-12(8-10-13)16-14-5-3-4-6-15(14)17(21)20-19-16/h3-10H,2,11H2,1H3,(H,20,21)