methyl (2S)-4-(4-chloranyl-2-cyclohexyl-phenoxy)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-4-(4-chloranyl-2-cyclohexyl-phenoxy)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-4-(4-chloro-2-cyclohexyl-phenoxy)pyrrolidine-2-carboxylate CAS Name: (2S)-4-(4-chloro-2-cyclohexylphenoxy)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-4-(4-chloro-2-cyclohexylphenoxy)pyrrolidine-2-carboxylate Traditional Name: (2S)-4-(4-chloro-2-cyclohexyl-phenoxy)pyrrolidine-2-carboxylic acid methyl ester Formula: C18H24ClNO3 MolecularWeight: 337.84106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1)OC2=C(C=C(C=C2)Cl)C3CCCCC3

Isomeric SMILES

COC(=O)[C@@H]1CC(CN1)OC2=C(C=C(C=C2)Cl)C3CCCCC3

InChI

InChI=1S/C18H24ClNO3/c1-22-18(21)16-10-14(11-20-16)23-17-8-7-13(19)9-15(17)12-5-3-2-4-6-12/h7-9,12,14,16,20H,2-6,10-11H2,1H3/t14?,16-/m0/s1