methyl (2S)-4-(4-chloranyl-3,5-dimethyl-phenoxy)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-4-(4-chloranyl-3,5-dimethyl-phenoxy)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-4-(4-chloro-3,5-dimethyl-phenoxy)pyrrolidine-2-carboxylate CAS Name: (2S)-4-(4-chloro-3,5-dimethylphenoxy)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-4-(4-chloro-3,5-dimethylphenoxy)pyrrolidine-2-carboxylate Traditional Name: (2S)-4-(4-chloro-3,5-dimethyl-phenoxy)pyrrolidine-2-carboxylic acid methyl ester Formula: C14H18ClNO3 MolecularWeight: 283.75062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2CC(NC2)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2C[C@H](NC2)C(=O)OC

InChI

InChI=1S/C14H18ClNO3/c1-8-4-10(5-9(2)13(8)15)19-11-6-12(16-7-11)14(17)18-3/h4-5,11-12,16H,6-7H2,1-3H3/t11?,12-/m0/s1