4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-phenylmethoxy-benzenecarbonitrile

Systemtic Name: 4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-phenylmethoxy-benzenecarbonitrile Openeye Name: 3-benzyloxy-4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-3-phenylmethoxybenzonitrile IUPAC Name: 4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-3-phenylmethoxybenzonitrile Traditional Name: 3-benzoxy-4-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]benzonitrile Formula: C27H26ClN3O3 MolecularWeight: 475.96664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=C(C=C(C=C3)C#N)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=C(C=C(C=C3)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C27H26ClN3O3/c28-24-9-6-21(7-10-24)18-30-12-14-31(15-13-30)27(32)20-34-25-11-8-23(17-29)16-26(25)33-19-22-4-2-1-3-5-22/h1-11,16H,12-15,18-20H2