2-methyl-2-[2-methyl-5-[(3S)-1-[2-[4-(trifluoromethyl)phenyl]ethoxycarbonyl]piperidin-3-yl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[2-methyl-5-[(3S)-1-[2-[4-(trifluoromethyl)phenyl]ethoxycarbonyl]piperidin-3-yl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[2-methyl-5-[(3S)-1-[2-[4-(trifluoromethyl)phenyl]ethoxycarbonyl]-3-piperidyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[2-methyl-5-[(3S)-1-[oxo-[2-[4-(trifluoromethyl)phenyl]ethoxy]methyl]-3-piperidinyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[2-methyl-5-[(3S)-1-[2-[4-(trifluoromethyl)phenyl]ethoxycarbonyl]piperidin-3-yl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[2-methyl-5-[(3S)-1-[2-[4-(trifluoromethyl)phenyl]ethoxycarbonyl]-3-piperidyl]phenoxy]propionic acid Formula: C26H30F3NO5 MolecularWeight: 493.51531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2CCCN(C2)C(=O)OCCC3=CC=C(C=C3)C(F)(F)F)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H]2CCCN(C2)C(=O)OCCC3=CC=C(C=C3)C(F)(F)F)OC(C)(C)C(=O)O

InChI

InChI=1S/C26H30F3NO5/c1-17-6-9-19(15-22(17)35-25(2,3)23(31)32)20-5-4-13-30(16-20)24(33)34-14-12-18-7-10-21(11-8-18)26(27,28)29/h6-11,15,20H,4-5,12-14,16H2,1-3H3,(H,31,32)/t20-/m1/s1