1-[(2S,3S,5R)-5-nonyl-2-(phenylmethyl)pyrrolidin-3-yl]ethanone

Systemtic Name: 1-[(2S,3S,5R)-5-nonyl-2-(phenylmethyl)pyrrolidin-3-yl]ethanone Openeye Name: 1-[(2S,3S,5R)-2-benzyl-5-nonyl-pyrrolidin-3-yl]ethanone CAS Name: 1-[(2S,3S,5R)-5-nonyl-2-(phenylmethyl)-3-pyrrolidinyl]ethanone IUPAC Name: 1-[(2S,3S,5R)-2-benzyl-5-nonylpyrrolidin-3-yl]ethanone Traditional Name: 1-[(2S,3S,5R)-2-benzyl-5-nonyl-pyrrolidin-3-yl]ethanone Formula: C22H35NO MolecularWeight: 329.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CC(C(N1)CC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CCCCCCCCC[C@@H]1C[C@@H]([C@@H](N1)CC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C22H35NO/c1-3-4-5-6-7-8-12-15-20-17-21(18(2)24)22(23-20)16-19-13-10-9-11-14-19/h9-11,13-14,20-23H,3-8,12,15-17H2,1-2H3/t20-,21-,22+/m1/s1