tert-butyl (2S,4R)-4-[(4-ethoxyphenyl)methyl]-2-(hydroxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4R)-4-[(4-ethoxyphenyl)methyl]-2-(hydroxymethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4R)-4-[(4-ethoxyphenyl)methyl]-2-(hydroxymethyl)pyrrolidine-1-carboxylate CAS Name: (2S,4R)-4-[(4-ethoxyphenyl)methyl]-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4R)-4-[(4-ethoxyphenyl)methyl]-2-(hydroxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-(4-ethoxybenzyl)-2-methylol-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H29NO4 MolecularWeight: 335.43786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2CC(N(C2)C(=O)OC(C)(C)C)CO

Isomeric SMILES

CCOC1=CC=C(C=C1)C[C@@H]2C[C@H](N(C2)C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C19H29NO4/c1-5-23-17-8-6-14(7-9-17)10-15-11-16(13-21)20(12-15)18(22)24-19(2,3)4/h6-9,15-16,21H,5,10-13H2,1-4H3/t15-,16+/m1/s1