5-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanyl-propoxy]-8-oxidanyl-3,4-dihydro-1H-quinolin-2-one

Systemtic Name: 5-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanyl-propoxy]-8-oxidanyl-3,4-dihydro-1H-quinolin-2-one Openeye Name: 5-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-hydroxy-propoxy]-8-hydroxy-3,4-dihydro-1H-quinolin-2-one CAS Name: 5-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-hydroxypropoxy]-8-hydroxy-3,4-dihydro-1H-quinolin-2-one IUPAC Name: 5-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-hydroxypropoxy]-8-hydroxy-3,4-dihydro-1H-quinolin-2-one Traditional Name: 5-[3-(homopiperonylamino)-2-hydroxy-propoxy]-8-hydroxy-3,4-dihydrocarbostyril Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C(C=CC(=C21)OCC(CNCCC3=CC4=C(C=C3)OCO4)O)O

Isomeric SMILES

C1CC(=O)NC2=C(C=CC(=C21)OCC(CNCCC3=CC4=C(C=C3)OCO4)O)O

InChI

InChI=1S/C21H24N2O6/c24-14(10-22-8-7-13-1-4-18-19(9-13)29-12-28-18)11-27-17-5-3-16(25)21-15(17)2-6-20(26)23-21/h1,3-5,9,14,22,24-25H,2,6-8,10-12H2,(H,23,26)