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

Systemtic Name: 2-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoylamino]-N-(phenylmethyl)benzamide Openeye Name: 2-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]amino]-N-benzyl-benzamide CAS Name: 2-[[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: 2-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]amino]-N-benzylbenzamide Traditional Name: N-benzyl-2-[[2-(4-piperonylpiperazino)acetyl]amino]benzamide Formula: C28H30N4O4 MolecularWeight: 486.5622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O4/c33-27(30-24-9-5-4-8-23(24)28(34)29-17-21-6-2-1-3-7-21)19-32-14-12-31(13-15-32)18-22-10-11-25-26(16-22)36-20-35-25/h1-11,16H,12-15,17-20H2,(H,29,34)(H,30,33)