2-[4-[2-[(4-fluorophenyl)carbamoyl-heptyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-heptyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-heptyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[[(4-fluoroanilino)-oxomethyl]-heptylamino]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-heptylamino]ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-heptyl-amino]ethyl]phenoxy]-2-methyl-propionic acid Formula: C26H35FN2O4 MolecularWeight: 458.565503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CCCCCCCN(CCC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C26H35FN2O4/c1-4-5-6-7-8-18-29(25(32)28-22-13-11-21(27)12-14-22)19-17-20-9-15-23(16-10-20)33-26(2,3)24(30)31/h9-16H,4-8,17-19H2,1-3H3,(H,28,32)(H,30,31)