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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-ethylphenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-ethylphenyl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(3-ethylphenyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-ethylphenyl)acetamide Traditional Name: N-(3-ethylphenyl)-2-(4-piperonylpiperazino)acetamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

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