5-[[(4-chloranylphthalazin-1-yl)amino]methyl]-2-methoxy-benzenecarbonitrile

Systemtic Name: 5-[[(4-chloranylphthalazin-1-yl)amino]methyl]-2-methoxy-benzenecarbonitrile Openeye Name: 5-[[(4-chlorophthalazin-1-yl)amino]methyl]-2-methoxy-benzonitrile CAS Name: 5-[[(4-chloro-1-phthalazinyl)amino]methyl]-2-methoxybenzonitrile IUPAC Name: 5-[[(4-chlorophthalazin-1-yl)amino]methyl]-2-methoxybenzonitrile Traditional Name: 5-[[(4-chlorophthalazin-1-yl)amino]methyl]-2-methoxy-benzonitrile Formula: C17H13ClN4O MolecularWeight: 324.76432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=CC=CC=C32)Cl)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=CC=CC=C32)Cl)C#N

InChI

InChI=1S/C17H13ClN4O/c1-23-15-7-6-11(8-12(15)9-19)10-20-17-14-5-3-2-4-13(14)16(18)21-22-17/h2-8H,10H2,1H3,(H,20,22)