N-[(2S,3R)-1,3-bis(oxidanyl)-5-(2-oxidanylidenechromen-7-yl)oxy-pentan-2-yl]hexadecanamide

Systemtic Name: N-[(2S,3R)-1,3-bis(oxidanyl)-5-(2-oxidanylidenechromen-7-yl)oxy-pentan-2-yl]hexadecanamide Openeye Name: N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)-4-(2-oxochromen-7-yl)oxy-butyl]hexadecanamide CAS Name: N-[(2S,3R)-1,3-dihydroxy-5-[(2-oxo-1-benzopyran-7-yl)oxy]pentan-2-yl]hexadecanamide IUPAC Name: N-[(2S,3R)-1,3-dihydroxy-5-(2-oxochromen-7-yl)oxypentan-2-yl]hexadecanamide Traditional Name: N-[(1S,2R)-2-hydroxy-4-(2-ketochromen-7-yl)oxy-1-methylol-butyl]palmitamide Formula: C30H47NO6 MolecularWeight: 517.69728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CO)C(CCOC1=CC2=C(C=C1)C=CC(=O)O2)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](CCOC1=CC2=C(C=C1)C=CC(=O)O2)O

InChI

InChI=1S/C30H47NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-29(34)31-26(23-32)27(33)20-21-36-25-18-16-24-17-19-30(35)37-28(24)22-25/h16-19,22,26-27,32-33H,2-15,20-21,23H2,1H3,(H,31,34)/t26-,27+/m0/s1