N-[(2R,4S,5S)-4-methyl-4-pentadec-1-ynyl-2-phenyl-1,3-dioxan-5-yl]dodecanamide

Systemtic Name: N-[(2R,4S,5S)-4-methyl-4-pentadec-1-ynyl-2-phenyl-1,3-dioxan-5-yl]dodecanamide Openeye Name: N-[(2R,4S,5S)-4-methyl-4-pentadec-1-ynyl-2-phenyl-1,3-dioxan-5-yl]dodecanamide CAS Name: N-[(2R,4S,5S)-4-methyl-4-pentadec-1-ynyl-2-phenyl-1,3-dioxan-5-yl]dodecanamide IUPAC Name: N-[(2R,4S,5S)-4-methyl-4-pentadec-1-ynyl-2-phenyl-1,3-dioxan-5-yl]dodecanamide Traditional Name: N-[(2R,4S,5S)-4-methyl-4-pentadec-1-ynyl-2-phenyl-1,3-dioxan-5-yl]lauramide Formula: C38H63NO3 MolecularWeight: 581.91172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC#CC1(C(COC(O1)C2=CC=CC=C2)NC(=O)CCCCCCCCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCC#C[C@]1([C@H](CO[C@H](O1)C2=CC=CC=C2)NC(=O)CCCCCCCCCCC)C

InChI

InChI=1S/C38H63NO3/c1-4-6-8-10-12-14-15-16-17-19-21-23-28-32-38(3)35(33-41-37(42-38)34-29-25-24-26-30-34)39-36(40)31-27-22-20-18-13-11-9-7-5-2/h24-26,29-30,35,37H,4-23,27,31,33H2,1-3H3,(H,39,40)/t35-,37+,38-/m0/s1