methyl (Z,2S)-2-[(4-methylphenyl)sulfonylamino]-11-oxidanyl-undec-7-en-5,9-diynoate

Systemtic Name: methyl (Z,2S)-2-[(4-methylphenyl)sulfonylamino]-11-oxidanyl-undec-7-en-5,9-diynoate Openeye Name: methyl (Z,2S)-11-hydroxy-2-(p-tolylsulfonylamino)undec-7-en-5,9-diynoate CAS Name: (Z,2S)-11-hydroxy-2-[(4-methylphenyl)sulfonylamino]undec-7-en-5,9-diynoic acid methyl ester IUPAC Name: methyl (Z,2S)-11-hydroxy-2-[(4-methylphenyl)sulfonylamino]undec-7-en-5,9-diynoate Traditional Name: (Z,2S)-11-hydroxy-2-(tosylamino)undec-7-en-5,9-diynoic acid methyl ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC#CC=CC#CCO)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCC#C/C=C\C#CCO)C(=O)OC

InChI

InChI=1S/C19H21NO5S/c1-16-11-13-17(14-12-16)26(23,24)20-18(19(22)25-2)10-8-6-4-3-5-7-9-15-21/h3,5,11-14,18,20-21H,8,10,15H2,1-2H3/b5-3-/t18-/m0/s1