2-[[3,5-bis(2-methylbutan-2-yl)-4-oxidanyl-phenyl]methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate

Systemtic Name: 2-[[3,5-bis(2-methylbutan-2-yl)-4-oxidanyl-phenyl]methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate Openeye Name: 2-[[3,5-bis(1,1-dimethylpropyl)-4-hydroxy-phenyl]methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate CAS Name: N-(4-azidosulfonylphenyl)carbamic acid 2-[[4-hydroxy-3,5-bis(2-methylbutan-2-yl)phenyl]methoxy]ethyl ester IUPAC Name: 2-[[4-hydroxy-3,5-bis(2-methylbutan-2-yl)phenyl]methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate Traditional Name: N-(4-azidosulfonylphenyl)carbamic acid 2-(3,5-ditert-amyl-4-hydroxy-benzyl)oxyethyl ester Formula: C26H36N4O6S MolecularWeight: 532.65224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)COCCOC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)COCCOC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C26H36N4O6S/c1-7-25(3,4)21-15-18(16-22(23(21)31)26(5,6)8-2)17-35-13-14-36-24(32)28-19-9-11-20(12-10-19)37(33,34)30-29-27/h9-12,15-16,31H,7-8,13-14,17H2,1-6H3,(H,28,32)