3-(1,3-benzodioxol-5-yl)-N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-ethyl-1-piperazinyl)phenyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-ethylpiperazino)phenyl]propionamide Formula: C22H26ClN3O3 MolecularWeight: 415.91314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26ClN3O3/c1-2-25-9-11-26(12-10-25)19-6-5-17(23)14-18(19)24-22(27)8-4-16-3-7-20-21(13-16)29-15-28-20/h3,5-7,13-14H,2,4,8-12,15H2,1H3,(H,24,27)