2-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoylamino]-N-phenyl-benzamide

Systemtic Name: 2-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoylamino]-N-phenyl-benzamide Openeye Name: 2-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]amino]-N-phenyl-benzamide CAS Name: 2-[[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]amino]-N-phenylbenzamide Traditional Name: N-phenyl-2-[[2-(4-piperonylpiperazino)acetyl]amino]benzamide Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H28N4O4/c32-26(29-23-9-5-4-8-22(23)27(33)28-21-6-2-1-3-7-21)18-31-14-12-30(13-15-31)17-20-10-11-24-25(16-20)35-19-34-24/h1-11,16H,12-15,17-19H2,(H,28,33)(H,29,32)