methyl (1E,5S,8S)-8-methoxycarbonyloxy-5-[(4-methylphenyl)sulfonylamino]cyclooctene-1-carboxylate

Systemtic Name: methyl (1E,5S,8S)-8-methoxycarbonyloxy-5-[(4-methylphenyl)sulfonylamino]cyclooctene-1-carboxylate Openeye Name: methyl (1E,5S,8S)-8-methoxycarbonyloxy-5-(p-tolylsulfonylamino)cyclooctene-1-carboxylate CAS Name: (1E,5S,8S)-8-methoxycarbonyloxy-5-[(4-methylphenyl)sulfonylamino]-1-cyclooctenecarboxylic acid methyl ester IUPAC Name: methyl (1E,5S,8S)-8-methoxycarbonyloxy-5-[(4-methylphenyl)sulfonylamino]cyclooctene-1-carboxylate Traditional Name: (1E,5S,8S)-8-carbomethoxyoxy-5-(tosylamino)cyclooctene-1-carboxylic acid methyl ester Formula: C19H25NO7S MolecularWeight: 411.4693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCC=C(C(CC2)OC(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H]2CC/C=C(\[C@H](CC2)OC(=O)OC)/C(=O)OC

InChI

InChI=1S/C19H25NO7S/c1-13-7-10-15(11-8-13)28(23,24)20-14-5-4-6-16(18(21)25-2)17(12-9-14)27-19(22)26-3/h6-8,10-11,14,17,20H,4-5,9,12H2,1-3H3/b16-6+/t14-,17-/m0/s1