4-methyl-N-[(2S,3S,4R)-4-oxidanyl-1,3-bis(phenylmethoxy)hexadecan-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(2S,3S,4R)-4-oxidanyl-1,3-bis(phenylmethoxy)hexadecan-2-yl]benzenesulfonamide Openeye Name: N-[(1S,2S,3R)-2-benzyloxy-1-(benzyloxymethyl)-3-hydroxy-pentadecyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S,3S,4R)-4-hydroxy-1,3-bis(phenylmethoxy)hexadecan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S,3S,4R)-4-hydroxy-1,3-bis(phenylmethoxy)hexadecan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,2S,3R)-2-benzoxy-1-(benzoxymethyl)-3-hydroxy-pentadecyl]-4-methyl-benzenesulfonamide Formula: C37H53NO5S MolecularWeight: 623.88542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(C(COCC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCCCCC[C@H]([C@H]([C@H](COCC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3)O

InChI

InChI=1S/C37H53NO5S/c1-3-4-5-6-7-8-9-10-11-18-23-36(39)37(43-29-33-21-16-13-17-22-33)35(30-42-28-32-19-14-12-15-20-32)38-44(40,41)34-26-24-31(2)25-27-34/h12-17,19-22,24-27,35-39H,3-11,18,23,28-30H2,1-2H3/t35-,36+,37-/m0/s1