2-[(3,5-didodecyl-4-oxidanyl-phenyl)methoxy]ethyl N-(3-azidosulfonylpropyl)carbamate

Systemtic Name: 2-[(3,5-didodecyl-4-oxidanyl-phenyl)methoxy]ethyl N-(3-azidosulfonylpropyl)carbamate Openeye Name: 2-[(3,5-didodecyl-4-hydroxy-phenyl)methoxy]ethyl N-(3-azidosulfonylpropyl)carbamate CAS Name: N-(3-azidosulfonylpropyl)carbamic acid 2-[(3,5-didodecyl-4-hydroxyphenyl)methoxy]ethyl ester IUPAC Name: 2-[(3,5-didodecyl-4-hydroxyphenyl)methoxy]ethyl N-(3-azidosulfonylpropyl)carbamate Traditional Name: N-(3-azidosulfonylpropyl)carbamic acid 2-(4-hydroxy-3,5-dilauryl-benzyl)oxyethyl ester Formula: C37H66N4O6S MolecularWeight: 695.00814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC(=C1O)CCCCCCCCCCCC)COCCOC(=O)NCCCS(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC(=C1O)CCCCCCCCCCCC)COCCOC(=O)NCCCS(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C37H66N4O6S/c1-3-5-7-9-11-13-15-17-19-21-24-34-30-33(31-35(36(34)42)25-22-20-18-16-14-12-10-8-6-4-2)32-46-27-28-47-37(43)39-26-23-29-48(44,45)41-40-38/h30-31,42H,3-29,32H2,1-2H3,(H,39,43)