1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]-4-(2-thienyl)butane-1,4-dione Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C(=O)CCC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C(=O)CCC(=O)C4=CC=CS4

InChI

InChI=1S/C22H23NO5S/c24-17(20-2-1-13-29-20)4-6-21(25)23-9-7-15(8-10-23)22(26)16-3-5-18-19(14-16)28-12-11-27-18/h1-3,5,13-15H,4,6-12H2