methyl 2-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[4-(2,4-dimethylanilino)phthalazin-1-yl]acetate CAS Name: 2-[4-(2,4-dimethylanilino)-1-phthalazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(2,4-dimethylanilino)phthalazin-1-yl]acetate Traditional Name: 2-[4-(2,4-dimethylanilino)phthalazin-1-yl]acetic acid methyl ester Formula: C19H19N3O2 MolecularWeight: 321.37306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)CC(=O)OC)C

InChI

InChI=1S/C19H19N3O2/c1-12-8-9-16(13(2)10-12)20-19-15-7-5-4-6-14(15)17(21-22-19)11-18(23)24-3/h4-10H,11H2,1-3H3,(H,20,22)