2-[3-[(3S)-1-(cyclohexylmethoxycarbonyl)piperidin-3-yl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[3-[(3S)-1-(cyclohexylmethoxycarbonyl)piperidin-3-yl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[3-[(3S)-1-(cyclohexylmethoxycarbonyl)-3-piperidyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[3-[(3S)-1-[cyclohexylmethoxy(oxo)methyl]-3-piperidinyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[3-[(3S)-1-(cyclohexylmethoxycarbonyl)piperidin-3-yl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[3-[(3S)-1-(cyclohexylmethoxycarbonyl)-3-piperidyl]phenoxy]-2-methyl-propionic acid Formula: C23H33NO5 MolecularWeight: 403.51182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=CC(=C1)C2CCCN(C2)C(=O)OCC3CCCCC3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=CC(=C1)[C@@H]2CCCN(C2)C(=O)OCC3CCCCC3

InChI

InChI=1S/C23H33NO5/c1-23(2,21(25)26)29-20-12-6-10-18(14-20)19-11-7-13-24(15-19)22(27)28-16-17-8-4-3-5-9-17/h6,10,12,14,17,19H,3-5,7-9,11,13,15-16H2,1-2H3,(H,25,26)/t19-/m1/s1