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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-(phenylcarbamoylamino)phenyl]ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-(phenylcarbamoylamino)phenyl]acetamide CAS Name: N-[4-[[anilino(oxo)methyl]amino]phenyl]-2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-(phenylcarbamoylamino)phenyl]acetamide Traditional Name: N-[4-(phenylcarbamoylamino)phenyl]-2-(4-piperonylpiperazino)acetamide Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=C(C=C4)NC(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=C(C=C4)NC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H29N5O4/c33-26(28-22-7-9-23(10-8-22)30-27(34)29-21-4-2-1-3-5-21)18-32-14-12-31(13-15-32)17-20-6-11-24-25(16-20)36-19-35-24/h1-11,16H,12-15,17-19H2,(H,28,33)(H2,29,30,34)