methyl 1-[(2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(2S)-2-(4-chloro-3,5-dimethyl-phenoxy)propanoyl]piperidine-4-carboxylate CAS Name: 1-[(2S)-2-(4-chloro-3,5-dimethylphenoxy)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2S)-2-(4-chloro-3,5-dimethylphenoxy)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-2-(4-chloro-3,5-dimethyl-phenoxy)propanoyl]isonipecotic acid methyl ester Formula: C18H24ClNO4 MolecularWeight: 353.84046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)N2CCC(CC2)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)O[C@@H](C)C(=O)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C18H24ClNO4/c1-11-9-15(10-12(2)16(11)19)24-13(3)17(21)20-7-5-14(6-8-20)18(22)23-4/h9-10,13-14H,5-8H2,1-4H3/t13-/m0/s1