7-[[2,4-bis(fluoranyl)phenyl]carbamoyl-[2-[4-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyphenyl]ethyl]amino]heptanoic acid

Systemtic Name: 7-[[2,4-bis(fluoranyl)phenyl]carbamoyl-[2-[4-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyphenyl]ethyl]amino]heptanoic acid Openeye Name: 7-[(2,4-difluorophenyl)carbamoyl-[2-[4-(2-hydroxy-1,1-dimethyl-2-oxo-ethoxy)phenyl]ethyl]amino]heptanoic acid CAS Name: 7-[[(2,4-difluoroanilino)-oxomethyl]-[2-[4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxyphenyl]ethyl]amino]heptanoic acid IUPAC Name: 7-[(2,4-difluorophenyl)carbamoyl-[2-[4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxyphenyl]ethyl]amino]heptanoic acid Traditional Name: 7-[(2,4-difluorophenyl)carbamoyl-[2-[4-(2-hydroxy-2-keto-1,1-dimethyl-ethoxy)phenyl]ethyl]amino]enanthic acid Formula: C26H32F2N2O6 MolecularWeight: 506.538886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCN(CCCCCCC(=O)O)C(=O)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCN(CCCCCCC(=O)O)C(=O)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C26H32F2N2O6/c1-26(2,24(33)34)36-20-11-8-18(9-12-20)14-16-30(15-6-4-3-5-7-23(31)32)25(35)29-22-13-10-19(27)17-21(22)28/h8-13,17H,3-7,14-16H2,1-2H3,(H,29,35)(H,31,32)(H,33,34)