3-[2-[[(2R)-3-[4-[3,4-bis(chloranyl)-2-methyl-phenoxy]piperidin-1-yl]-2-oxidanyl-propyl]amino]-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 3-[2-[[(2R)-3-[4-[3,4-bis(chloranyl)-2-methyl-phenoxy]piperidin-1-yl]-2-oxidanyl-propyl]amino]-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 3-[2-[[(2R)-3-[4-(3,4-dichloro-2-methyl-phenoxy)-1-piperidyl]-2-hydroxy-propyl]amino]-2-oxo-ethoxy]benzoic acid CAS Name: 3-[2-[[(2R)-3-[4-(3,4-dichloro-2-methylphenoxy)-1-piperidinyl]-2-hydroxypropyl]amino]-2-oxoethoxy]benzoic acid IUPAC Name: 3-[2-[[(2R)-3-[4-(3,4-dichloro-2-methylphenoxy)piperidin-1-yl]-2-hydroxypropyl]amino]-2-oxoethoxy]benzoic acid Traditional Name: 3-[2-[[(2R)-3-[4-(3,4-dichloro-2-methyl-phenoxy)piperidino]-2-hydroxy-propyl]amino]-2-keto-ethoxy]benzoic acid Formula: C24H28Cl2N2O6 MolecularWeight: 511.39492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)Cl)OC2CCN(CC2)CC(CNC(=O)COC3=CC=CC(=C3)C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1Cl)Cl)OC2CCN(CC2)C[C@@H](CNC(=O)COC3=CC=CC(=C3)C(=O)O)O

InChI

InChI=1S/C24H28Cl2N2O6/c1-15-21(6-5-20(25)23(15)26)34-18-7-9-28(10-8-18)13-17(29)12-27-22(30)14-33-19-4-2-3-16(11-19)24(31)32/h2-6,11,17-18,29H,7-10,12-14H2,1H3,(H,27,30)(H,31,32)/t17-/m1/s1