5-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-7-methyl-2-oxidanylidene-1H-quinolin-8-yl]oxy]pentanoic acid

Systemtic Name: 5-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-7-methyl-2-oxidanylidene-1H-quinolin-8-yl]oxy]pentanoic acid Openeye Name: 5-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-7-methyl-2-oxo-1H-quinolin-8-yl]oxy]pentanoic acid CAS Name: 5-[[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-7-methyl-2-oxo-1H-quinolin-8-yl]oxy]pentanoic acid IUPAC Name: 5-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-7-methyl-2-oxo-1H-quinolin-8-yl]oxy]pentanoic acid Traditional Name: 5-[[2-keto-7-methyl-3-(piperonylcarbamoyl)-1H-quinolin-8-yl]oxy]valeric acid Formula: C24H24N2O7 MolecularWeight: 452.45656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)C(=O)NCC3=CC4=C(C=C3)OCO4)OCCCCC(=O)O

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)C(=O)NCC3=CC4=C(C=C3)OCO4)OCCCCC(=O)O

InChI

InChI=1S/C24H24N2O7/c1-14-5-7-16-11-17(23(29)25-12-15-6-8-18-19(10-15)33-13-32-18)24(30)26-21(16)22(14)31-9-3-2-4-20(27)28/h5-8,10-11H,2-4,9,12-13H2,1H3,(H,25,29)(H,26,30)(H,27,28)