N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-3-pyrrol-1-yl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-3-pyrrol-1-yl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(o-tolyl)-3-pyrrol-1-yl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-3-(1-pyrrolyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-3-pyrrol-1-ylpropanamide Traditional Name: 3-(o-tolyl)-N-piperonyl-3-pyrrol-1-yl-propionamide Formula: C22H22N2O3 MolecularWeight: 362.42168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)NCC2=CC3=C(C=C2)OCO3)N4C=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)NCC2=CC3=C(C=C2)OCO3)N4C=CC=C4

InChI

InChI=1S/C22H22N2O3/c1-16-6-2-3-7-18(16)19(24-10-4-5-11-24)13-22(25)23-14-17-8-9-20-21(12-17)27-15-26-20/h2-12,19H,13-15H2,1H3,(H,23,25)