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

Systemtic Name: 4-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-ethoxy-benzenecarbonitrile Openeye Name: 4-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]-3-ethoxy-benzonitrile CAS Name: 4-[2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-3-ethoxybenzonitrile IUPAC Name: 4-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-3-ethoxybenzonitrile Traditional Name: 4-[2-[4-(3-chlorobenzyl)piperazino]-2-keto-ethoxy]-3-ethoxy-benzonitrile Formula: C22H24ClN3O3 MolecularWeight: 413.89726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H24ClN3O3/c1-2-28-21-13-17(14-24)6-7-20(21)29-16-22(27)26-10-8-25(9-11-26)15-18-4-3-5-19(23)12-18/h3-7,12-13H,2,8-11,15-16H2,1H3