1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-5-thiophen-2-yl-pentane-1,5-dione

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-5-thiophen-2-yl-pentane-1,5-dione Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]-5-(2-thienyl)pentane-1,5-dione CAS Name: 1-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-5-thiophen-2-ylpentane-1,5-dione IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]-5-thiophen-2-ylpentane-1,5-dione Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]-5-(2-thienyl)pentane-1,5-dione Formula: C23H25NO5S MolecularWeight: 427.5133

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO5S/c25-18(21-4-2-14-30-21)3-1-5-22(26)24-10-8-16(9-11-24)23(27)17-6-7-19-20(15-17)29-13-12-28-19/h2,4,6-7,14-16H,1,3,5,8-13H2