2-[(3-dodecyl-5-methyl-4-oxidanyl-phenyl)methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate

Systemtic Name: 2-[(3-dodecyl-5-methyl-4-oxidanyl-phenyl)methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate Openeye Name: 2-[(3-dodecyl-4-hydroxy-5-methyl-phenyl)methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate CAS Name: N-(4-azidosulfonylphenyl)carbamic acid 2-[(3-dodecyl-4-hydroxy-5-methylphenyl)methoxy]ethyl ester IUPAC Name: 2-[(3-dodecyl-4-hydroxy-5-methylphenyl)methoxy]ethyl N-(4-azidosulfonylphenyl)carbamate Traditional Name: N-(4-azidosulfonylphenyl)carbamic acid 2-(4-hydroxy-3-lauryl-5-methyl-benzyl)oxyethyl ester Formula: C29H42N4O6S MolecularWeight: 574.73198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC(=C1O)C)COCCOC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC(=C1O)C)COCCOC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C29H42N4O6S/c1-3-4-5-6-7-8-9-10-11-12-13-25-21-24(20-23(2)28(25)34)22-38-18-19-39-29(35)31-26-14-16-27(17-15-26)40(36,37)33-32-30/h14-17,20-21,34H,3-13,18-19,22H2,1-2H3,(H,31,35)