tert-butyl N-(4-methylphenyl)sulfonyl-N-(8-phenylocta-2,7-diynyl)carbamate

Systemtic Name: tert-butyl N-(4-methylphenyl)sulfonyl-N-(8-phenylocta-2,7-diynyl)carbamate Openeye Name: tert-butyl N-(8-phenylocta-2,7-diynyl)-N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonyl-N-(8-phenylocta-2,7-diynyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(4-methylphenyl)sulfonyl-N-(8-phenylocta-2,7-diynyl)carbamate Traditional Name: N-(8-phenylocta-2,7-diynyl)-N-tosyl-carbamic acid tert-butyl ester Formula: C26H29NO4S MolecularWeight: 451.57776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29NO4S/c1-22-17-19-24(20-18-22)32(29,30)27(25(28)31-26(2,3)4)21-13-8-6-5-7-10-14-23-15-11-9-12-16-23/h9,11-12,15-20H,5-7,21H2,1-4H3