methyl [2-methyl-2-[(4-methylphenyl)sulfonylamino]undec-3-yn-5-yl] carbonate

Systemtic Name: methyl [2-methyl-2-[(4-methylphenyl)sulfonylamino]undec-3-yn-5-yl] carbonate Openeye Name: methyl 1-[3-methyl-3-(p-tolylsulfonylamino)but-1-ynyl]heptyl carbonate CAS Name: carbonic acid methyl [2-methyl-2-[(4-methylphenyl)sulfonylamino]undec-3-yn-5-yl] ester IUPAC Name: methyl [2-methyl-2-[(4-methylphenyl)sulfonylamino]undec-3-yn-5-yl] carbonate Traditional Name: carbonic acid [1-hexyl-4-methyl-4-(tosylamino)pent-2-ynyl] methyl ester Formula: C21H31NO5S MolecularWeight: 409.53954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C#CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)OC

Isomeric SMILES

CCCCCCC(C#CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)OC

InChI

InChI=1S/C21H31NO5S/c1-6-7-8-9-10-18(27-20(23)26-5)15-16-21(3,4)22-28(24,25)19-13-11-17(2)12-14-19/h11-14,18,22H,6-10H2,1-5H3