tert-butyl (2S)-2-[(4-methoxycarbonyl-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(4-methoxycarbonyl-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(4-methoxycarbonyl-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(4-methoxycarbonyl-3-methylphenoxy)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(4-methoxycarbonyl-3-methylphenoxy)methyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(4-carbomethoxy-3-methyl-phenoxy)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2CCCN2C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@@H]2CCCN2C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C19H27NO5/c1-13-11-15(8-9-16(13)17(21)23-5)24-12-14-7-6-10-20(14)18(22)25-19(2,3)4/h8-9,11,14H,6-7,10,12H2,1-5H3/t14-/m0/s1