ethyl 1-[3-(4-chloranyl-3-methyl-phenoxy)-2-oxidanyl-propyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(4-chloranyl-3-methyl-phenoxy)-2-oxidanyl-propyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(4-chloro-3-methyl-phenoxy)-2-hydroxy-propyl]piperidine-4-carboxylate CAS Name: 1-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-chloro-3-methyl-phenoxy)-2-hydroxy-propyl]isonipecotic acid ethyl ester Formula: C18H26ClNO4 MolecularWeight: 355.85634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(COC2=CC(=C(C=C2)Cl)C)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(COC2=CC(=C(C=C2)Cl)C)O

InChI

InChI=1S/C18H26ClNO4/c1-3-23-18(22)14-6-8-20(9-7-14)11-15(21)12-24-16-4-5-17(19)13(2)10-16/h4-5,10,14-15,21H,3,6-9,11-12H2,1-2H3