N-[4-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]phenyl]-2-phenoxy-benzamide

Systemtic Name: N-[4-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]phenyl]-2-phenoxy-benzamide Openeye Name: N-[4-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]phenyl]-2-phenoxy-benzamide CAS Name: N-[4-[4-[(3-cyanophenyl)methyl]-1-piperazinyl]phenyl]-2-phenoxybenzamide IUPAC Name: N-[4-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]phenyl]-2-phenoxybenzamide Traditional Name: N-[4-[4-(3-cyanobenzyl)piperazino]phenyl]-2-phenoxy-benzamide Formula: C31H28N4O2 MolecularWeight: 488.57962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C#N)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C#N)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4OC5=CC=CC=C5

InChI

InChI=1S/C31H28N4O2/c32-22-24-7-6-8-25(21-24)23-34-17-19-35(20-18-34)27-15-13-26(14-16-27)33-31(36)29-11-4-5-12-30(29)37-28-9-2-1-3-10-28/h1-16,21H,17-20,23H2,(H,33,36)