tert-butyl N-(4-methylphenyl)sulfonyl-N-(9-phenylnona-2,8-diynyl)carbamate

Systemtic Name: tert-butyl N-(4-methylphenyl)sulfonyl-N-(9-phenylnona-2,8-diynyl)carbamate Openeye Name: tert-butyl N-(9-phenylnona-2,8-diynyl)-N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonyl-N-(9-phenylnona-2,8-diynyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(4-methylphenyl)sulfonyl-N-(9-phenylnona-2,8-diynyl)carbamate Traditional Name: N-(9-phenylnona-2,8-diynyl)-N-tosyl-carbamic acid tert-butyl ester Formula: C27H31NO4S MolecularWeight: 465.60434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC#CCCCCC#CC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC#CCCCCC#CC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H31NO4S/c1-23-18-20-25(21-19-23)33(30,31)28(26(29)32-27(2,3)4)22-14-9-7-5-6-8-11-15-24-16-12-10-13-17-24/h10,12-13,16-21H,5-8,22H2,1-4H3