2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(p-tolyl)propanamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(4-methylphenyl)propanamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide Traditional Name: 2-(4-piperonylpiperazino)-N-(p-tolyl)propionamide Formula: C22H27N3O3 MolecularWeight: 381.46808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H27N3O3/c1-16-3-6-19(7-4-16)23-22(26)17(2)25-11-9-24(10-12-25)14-18-5-8-20-21(13-18)28-15-27-20/h3-8,13,17H,9-12,14-15H2,1-2H3,(H,23,26)