(2R,5S)-N-hexadecyl-5-phenyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R,5S)-N-hexadecyl-5-phenyl-pyrrolidine-2-carboxamide Openeye Name: (2R,5S)-N-hexadecyl-5-phenyl-pyrrolidine-2-carboxamide CAS Name: (2R,5S)-N-hexadecyl-5-phenyl-2-pyrrolidinecarboxamide IUPAC Name: (2R,5S)-N-hexadecyl-5-phenylpyrrolidine-2-carboxamide Traditional Name: (2R,5S)-N-cetyl-5-phenyl-pyrrolidine-2-carboxamide Formula: C27H46N2O MolecularWeight: 414.66694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)C1CCC(N1)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C27H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-28-27(30)26-22-21-25(29-26)24-19-16-15-17-20-24/h15-17,19-20,25-26,29H,2-14,18,21-23H2,1H3,(H,28,30)/t25-,26+/m0/s1