2-[4-[(6-butyl-1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonyl-methyl-amino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(6-butyl-1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonyl-methyl-amino]phenoxy]ethanoic acid Openeye Name: 2-[4-[(6-butyl-2-hydroxy-1-methyl-4-oxo-quinoline-3-carbonyl)-methyl-amino]phenoxy]acetic acid CAS Name: 2-[4-[[(6-butyl-2-hydroxy-1-methyl-4-oxo-3-quinolinyl)-oxomethyl]-methylamino]phenoxy]acetic acid IUPAC Name: 2-[4-[(6-butyl-2-hydroxy-1-methyl-4-oxoquinoline-3-carbonyl)-methylamino]phenoxy]acetic acid Traditional Name: 2-[4-[(6-butyl-2-hydroxy-4-keto-1-methyl-quinoline-3-carbonyl)-methyl-amino]phenoxy]acetic acid Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=C(C2=O)C(=O)N(C)C3=CC=C(C=C3)OCC(=O)O)O)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C(=C(C2=O)C(=O)N(C)C3=CC=C(C=C3)OCC(=O)O)O)C

InChI

InChI=1S/C24H26N2O6/c1-4-5-6-15-7-12-19-18(13-15)22(29)21(24(31)26(19)3)23(30)25(2)16-8-10-17(11-9-16)32-14-20(27)28/h7-13,31H,4-6,14H2,1-3H3,(H,27,28)