1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-2-chloranyl-ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-2-chloranyl-ethanone Openeye Name: 1-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-chloro-ethanone CAS Name: 1-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-2-chloroethanone IUPAC Name: 1-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-chloroethanone Traditional Name: 2-chloro-1-(4-piperonyloylpiperazino)ethanone Formula: C14H15ClN2O4 MolecularWeight: 310.7329

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCl)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CN(CCN1C(=O)CCl)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H15ClN2O4/c15-8-13(18)16-3-5-17(6-4-16)14(19)10-1-2-11-12(7-10)21-9-20-11/h1-2,7H,3-6,8-9H2