ethyl (2S,4S)-4-butyl-1-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,4S)-4-butyl-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,4S)-1-benzyl-4-butyl-pyrrolidine-2-carboxylate CAS Name: (2S,4S)-4-butyl-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,4S)-1-benzyl-4-butylpyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-benzyl-4-butyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(N(C1)CC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCC[C@H]1C[C@H](N(C1)CC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H27NO2/c1-3-5-9-16-12-17(18(20)21-4-2)19(14-16)13-15-10-7-6-8-11-15/h6-8,10-11,16-17H,3-5,9,12-14H2,1-2H3/t16-,17-/m0/s1