3-[[3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[[3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-(phenylmethyl)amino]propanamide Openeye Name: 3-[[3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxy-propyl]-benzyl-amino]propanamide CAS Name: 3-[[3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[[3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-benzylamino]propanamide Traditional Name: 3-[benzyl-(2-hydroxy-3-piperonyloxy-propyl)amino]propionamide Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COCC(CN(CCC(=O)N)CC3=CC=CC=C3)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COCC(CN(CCC(=O)N)CC3=CC=CC=C3)O

InChI

InChI=1S/C21H26N2O5/c22-21(25)8-9-23(11-16-4-2-1-3-5-16)12-18(24)14-26-13-17-6-7-19-20(10-17)28-15-27-19/h1-7,10,18,24H,8-9,11-15H2,(H2,22,25)