2-(2-chloranyl-4-cyano-phenoxy)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-cyano-phenoxy)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(2-chloro-4-cyano-phenoxy)acetamide CAS Name: 2-(2-chloro-4-cyanophenoxy)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(2-chloro-4-cyanophenoxy)acetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-(2-chloro-4-cyano-phenoxy)acetamide Formula: C26H25ClN4O2 MolecularWeight: 460.9553

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC4=C(C=C(C=C4)C#N)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC4=C(C=C(C=C4)C#N)Cl

InChI

InChI=1S/C26H25ClN4O2/c27-24-16-21(17-28)6-11-25(24)33-19-26(32)29-22-7-9-23(10-8-22)31-14-12-30(13-15-31)18-20-4-2-1-3-5-20/h1-11,16H,12-15,18-19H2,(H,29,32)