2-[(4-azidosulfonylphenyl)carbamoyloxy]ethyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: 2-[(4-azidosulfonylphenyl)carbamoyloxy]ethyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate Openeye Name: 2-[(4-azidosulfonylphenyl)carbamoyloxy]ethyl 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid 2-[(4-azidosulfonylanilino)-oxomethoxy]ethyl ester IUPAC Name: 2-[(4-azidosulfonylphenyl)carbamoyloxy]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid 2-[(4-azidosulfonylphenyl)carbamoyloxy]ethyl ester Formula: C26H34N4O7S MolecularWeight: 546.63576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O7S/c1-25(2,3)20-15-17(16-21(23(20)32)26(4,5)6)7-12-22(31)36-13-14-37-24(33)28-18-8-10-19(11-9-18)38(34,35)30-29-27/h8-11,15-16,32H,7,12-14H2,1-6H3,(H,28,33)