2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]-N-propyl-acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]-N-propylacetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]-N-propylacetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]-N-propyl-acetamide Formula: C21H23N3O2 MolecularWeight: 349.42622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H23N3O2/c1-4-11-22-19(25)13-24-21(26)17-8-6-5-7-16(17)20(23-24)18-12-14(2)9-10-15(18)3/h5-10,12H,4,11,13H2,1-3H3,(H,22,25)