2-[4-[2-[(4-fluorophenyl)carbamoyl-hept-6-enyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-hept-6-enyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-hept-6-enyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[[(4-fluoroanilino)-oxomethyl]-hept-6-enylamino]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-hept-6-enylamino]ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[(4-fluorophenyl)carbamoyl-hept-6-enyl-amino]ethyl]phenoxy]-2-methyl-propionic acid Formula: C26H33FN2O4 MolecularWeight: 456.549623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33FN2O4/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/h4,9-16H,1,5-8,17-19H2,2-3H3,(H,28,32)(H,30,31)