1-[4-[[3-(1,3-benzodioxol-5-ylcarbonyl)piperidin-1-yl]methyl]thiophen-2-yl]ethanone

Systemtic Name: 1-[4-[[3-(1,3-benzodioxol-5-ylcarbonyl)piperidin-1-yl]methyl]thiophen-2-yl]ethanone Openeye Name: 1-[4-[[3-(1,3-benzodioxole-5-carbonyl)-1-piperidyl]methyl]-2-thienyl]ethanone CAS Name: 1-[4-[[3-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperidinyl]methyl]-2-thiophenyl]ethanone IUPAC Name: 1-[4-[[3-(1,3-benzodioxole-5-carbonyl)piperidin-1-yl]methyl]thiophen-2-yl]ethanone Traditional Name: 1-[4-[(3-piperonyloylpiperidino)methyl]-2-thienyl]ethanone Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)CN2CCCC(C2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CC(=CS1)CN2CCCC(C2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21NO4S/c1-13(22)19-7-14(11-26-19)9-21-6-2-3-16(10-21)20(23)15-4-5-17-18(8-15)25-12-24-17/h4-5,7-8,11,16H,2-3,6,9-10,12H2,1H3