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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzoylpiperazin-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzoyl-1-piperazinyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzoylpiperazin-1-yl)acetamide Traditional Name: 2-(4-benzoylpiperazino)-N-piperonyl-acetamide Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4/c25-20(22-13-16-6-7-18-19(12-16)28-15-27-18)14-23-8-10-24(11-9-23)21(26)17-4-2-1-3-5-17/h1-7,12H,8-11,13-15H2,(H,22,25)