2-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenoxy]ethanamide

Systemtic Name: 2-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenoxy]ethanamide Openeye Name: 2-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenoxy]acetamide CAS Name: 2-[3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]phenoxy]acetamide IUPAC Name: 2-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenoxy]acetamide Traditional Name: 2-[3-(4-piperonylpiperazine-1-carbonyl)phenoxy]acetamide Formula: C21H23N3O5 MolecularWeight: 397.42442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=CC=C4)OCC(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=CC=C4)OCC(=O)N

InChI

InChI=1S/C21H23N3O5/c22-20(25)13-27-17-3-1-2-16(11-17)21(26)24-8-6-23(7-9-24)12-15-4-5-18-19(10-15)29-14-28-18/h1-5,10-11H,6-9,12-14H2,(H2,22,25)