2-[3-[(3S)-1-[(4-cyclopropylphenyl)methoxycarbonyl]piperidin-3-yl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[3-[(3S)-1-[(4-cyclopropylphenyl)methoxycarbonyl]piperidin-3-yl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[3-[(3S)-1-[(4-cyclopropylphenyl)methoxycarbonyl]-3-piperidyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[3-[(3S)-1-[(4-cyclopropylphenyl)methoxy-oxomethyl]-3-piperidinyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[3-[(3S)-1-[(4-cyclopropylphenyl)methoxycarbonyl]piperidin-3-yl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[3-[(3S)-1-(4-cyclopropylbenzyl)oxycarbonyl-3-piperidyl]phenoxy]-2-methyl-propionic acid Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=CC(=C1)C2CCCN(C2)C(=O)OCC3=CC=C(C=C3)C4CC4

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=CC(=C1)[C@@H]2CCCN(C2)C(=O)OCC3=CC=C(C=C3)C4CC4

InChI

InChI=1S/C26H31NO5/c1-26(2,24(28)29)32-23-7-3-5-21(15-23)22-6-4-14-27(16-22)25(30)31-17-18-8-10-19(11-9-18)20-12-13-20/h3,5,7-11,15,20,22H,4,6,12-14,16-17H2,1-2H3,(H,28,29)/t22-/m1/s1