methyl 3-(5-chloranyl-2-phenylmethoxy-phenyl)-3-oxidanyl-2-(piperidin-1-ylmethyl)propanoate

Systemtic Name: methyl 3-(5-chloranyl-2-phenylmethoxy-phenyl)-3-oxidanyl-2-(piperidin-1-ylmethyl)propanoate Openeye Name: methyl 3-(2-benzyloxy-5-chloro-phenyl)-3-hydroxy-2-(1-piperidylmethyl)propanoate CAS Name: 3-(5-chloro-2-phenylmethoxyphenyl)-3-hydroxy-2-(1-piperidinylmethyl)propanoic acid methyl ester IUPAC Name: methyl 3-(5-chloro-2-phenylmethoxyphenyl)-3-hydroxy-2-(piperidin-1-ylmethyl)propanoate Traditional Name: 3-(2-benzoxy-5-chloro-phenyl)-3-hydroxy-2-(piperidinomethyl)propionic acid methyl ester Formula: C23H28ClNO4 MolecularWeight: 417.92572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1CCCCC1)C(C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C(CN1CCCCC1)C(C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)O

InChI

InChI=1S/C23H28ClNO4/c1-28-23(27)20(15-25-12-6-3-7-13-25)22(26)19-14-18(24)10-11-21(19)29-16-17-8-4-2-5-9-17/h2,4-5,8-11,14,20,22,26H,3,6-7,12-13,15-16H2,1H3