4-[3,5-di(butan-2-yl)-4-oxidanyl-phenyl]butyl N-(4-azidosulfonylbutyl)carbamate

Systemtic Name: 4-[3,5-di(butan-2-yl)-4-oxidanyl-phenyl]butyl N-(4-azidosulfonylbutyl)carbamate Openeye Name: 4-(4-hydroxy-3,5-disec-butyl-phenyl)butyl N-(4-azidosulfonylbutyl)carbamate CAS Name: N-(4-azidosulfonylbutyl)carbamic acid 4-[3,5-di(butan-2-yl)-4-hydroxyphenyl]butyl ester IUPAC Name: 4-[3,5-di(butan-2-yl)-4-hydroxyphenyl]butyl N-(4-azidosulfonylbutyl)carbamate Traditional Name: N-(4-azidosulfonylbutyl)carbamic acid 4-(4-hydroxy-3,5-disec-butyl-phenyl)butyl ester Formula: C23H38N4O5S MolecularWeight: 482.63662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=CC(=C1O)C(C)CC)CCCCOC(=O)NCCCCS(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CCC(C)C1=CC(=CC(=C1O)C(C)CC)CCCCOC(=O)NCCCCS(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C23H38N4O5S/c1-5-17(3)20-15-19(16-21(22(20)28)18(4)6-2)11-7-9-13-32-23(29)25-12-8-10-14-33(30,31)27-26-24/h15-18,28H,5-14H2,1-4H3,(H,25,29)