4-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]amino]benzamide

Systemtic Name: 4-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]amino]benzamide Openeye Name: 4-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-acetyl]amino]benzamide CAS Name: 4-[[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1,2-dioxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoacetyl]amino]benzamide Traditional Name: 4-[[2-keto-2-(4-piperonylpiperazino)acetyl]amino]benzamide Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C21H22N4O5/c22-19(26)15-2-4-16(5-3-15)23-20(27)21(28)25-9-7-24(8-10-25)12-14-1-6-17-18(11-14)30-13-29-17/h1-6,11H,7-10,12-13H2,(H2,22,26)(H,23,27)