(phenylmethyl) (2R,5S)-2-methyl-5-(3-oxidanylpropyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,5S)-2-methyl-5-(3-oxidanylpropyl)pyrrolidine-1-carboxylate Openeye Name: benzyl (2S,5R)-2-(3-hydroxypropyl)-5-methyl-pyrrolidine-1-carboxylate CAS Name: (2S,5R)-2-(3-hydroxypropyl)-5-methyl-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,5R)-2-(3-hydroxypropyl)-5-methylpyrrolidine-1-carboxylate Traditional Name: (2S,5R)-2-(3-hydroxypropyl)-5-methyl-pyrrolidine-1-carboxylic acid benzyl ester Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N1C(=O)OCC2=CC=CC=C2)CCCO

Isomeric SMILES

C[C@@H]1CC[C@H](N1C(=O)OCC2=CC=CC=C2)CCCO

InChI

InChI=1S/C16H23NO3/c1-13-9-10-15(8-5-11-18)17(13)16(19)20-12-14-6-3-2-4-7-14/h2-4,6-7,13,15,18H,5,8-12H2,1H3/t13-,15-/m1/s1