N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(4-pyridin-3-ylcarbonylpiperazin-2-yl)ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(4-pyridin-3-ylcarbonylpiperazin-2-yl)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(pyridine-3-carbonyl)piperazin-2-yl]acetamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-[oxo(3-pyridinyl)methyl]-2-piperazinyl]acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(pyridine-3-carbonyl)piperazin-2-yl]acetamide Traditional Name: N-homopiperonyl-2-(4-nicotinoylpiperazin-2-yl)acetamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)CC(=O)NCCC2=CC3=C(C=C2)OCO3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CC(N1)CC(=O)NCCC2=CC3=C(C=C2)OCO3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H24N4O4/c26-20(24-7-5-15-3-4-18-19(10-15)29-14-28-18)11-17-13-25(9-8-23-17)21(27)16-2-1-6-22-12-16/h1-4,6,10,12,17,23H,5,7-9,11,13-14H2,(H,24,26)