methyl (E,4S)-2-ethyl-5-methyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate

Systemtic Name: methyl (E,4S)-2-ethyl-5-methyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate Openeye Name: methyl (E,4S)-2-ethyl-5-methyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate CAS Name: (E,4S)-2-ethyl-5-methyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]-2-hexenoic acid methyl ester IUPAC Name: methyl (E,4S)-2-ethyl-5-methyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate Traditional Name: (E,4S)-2-ethyl-4-(mesitylsulfonylamino)-5-methyl-hex-2-enoic acid methyl ester Formula: C19H29NO4S MolecularWeight: 367.50286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC(C(C)C)NS(=O)(=O)C1=C(C=C(C=C1C)C)C)C(=O)OC

Isomeric SMILES

CC/C(=C\[C@H](C(C)C)NS(=O)(=O)C1=C(C=C(C=C1C)C)C)/C(=O)OC

InChI

InChI=1S/C19H29NO4S/c1-8-16(19(21)24-7)11-17(12(2)3)20-25(22,23)18-14(5)9-13(4)10-15(18)6/h9-12,17,20H,8H2,1-7H3/b16-11+/t17-/m1/s1