2-(4-chloranylphenoxy)-5-piperazin-1-yl-benzenecarbonitrile

Systemtic Name: 2-(4-chloranylphenoxy)-5-piperazin-1-yl-benzenecarbonitrile Openeye Name: 2-(4-chlorophenoxy)-5-piperazin-1-yl-benzonitrile CAS Name: 2-(4-chlorophenoxy)-5-(1-piperazinyl)benzonitrile IUPAC Name: 2-(4-chlorophenoxy)-5-piperazin-1-ylbenzonitrile Traditional Name: 2-(4-chlorophenoxy)-5-piperazino-benzonitrile Formula: C17H16ClN3O MolecularWeight: 313.78144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1CN(CCN1)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C17H16ClN3O/c18-14-1-4-16(5-2-14)22-17-6-3-15(11-13(17)12-19)21-9-7-20-8-10-21/h1-6,11,20H,7-10H2