tert-butyl N-[6-[(1S,2S)-2-azidocyclohexyl]hex-5-ynyl]-N-(4-methylphenyl)sulfonyl-carbamate

Systemtic Name: tert-butyl N-[6-[(1S,2S)-2-azidocyclohexyl]hex-5-ynyl]-N-(4-methylphenyl)sulfonyl-carbamate Openeye Name: tert-butyl N-[6-[(1S,2S)-2-azidocyclohexyl]hex-5-ynyl]-N-(p-tolylsulfonyl)carbamate CAS Name: N-[6-[(1S,2S)-2-azidocyclohexyl]hex-5-ynyl]-N-(4-methylphenyl)sulfonylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-[(1S,2S)-2-azidocyclohexyl]hex-5-ynyl]-N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-[6-[(1S,2S)-2-azidocyclohexyl]hex-5-ynyl]-N-tosyl-carbamic acid tert-butyl ester Formula: C24H34N4O4S MolecularWeight: 474.61616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCCC#CC2CCCCC2N=[N+]=[N-])C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCCC#C[C@@H]2CCCC[C@@H]2N=[N+]=[N-])C(=O)OC(C)(C)C

InChI

InChI=1S/C24H34N4O4S/c1-19-14-16-21(17-15-19)33(30,31)28(23(29)32-24(2,3)4)18-10-6-5-7-11-20-12-8-9-13-22(20)26-27-25/h14-17,20,22H,5-6,8-10,12-13,18H2,1-4H3/t20-,22+/m1/s1