[(E)-1-[5-methyl-4-(4-methylphenyl)sulfonyl-4,5-dihydro-1,3-oxazol-2-yl]but-1-enyl] butanoate

Systemtic Name: [(E)-1-[5-methyl-4-(4-methylphenyl)sulfonyl-4,5-dihydro-1,3-oxazol-2-yl]but-1-enyl] butanoate Openeye Name: [(E)-1-[5-methyl-4-(p-tolylsulfonyl)-4,5-dihydrooxazol-2-yl]but-1-enyl] butanoate CAS Name: butanoic acid [(E)-1-[5-methyl-4-(4-methylphenyl)sulfonyl-4,5-dihydrooxazol-2-yl]but-1-enyl] ester IUPAC Name: [(E)-1-[5-methyl-4-(4-methylphenyl)sulfonyl-4,5-dihydro-1,3-oxazol-2-yl]but-1-enyl] butanoate Traditional Name: butyric acid [(E)-1-(5-methyl-4-tosyl-2-oxazolin-2-yl)but-1-enyl] ester Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(=CCC)C1=NC(C(O1)C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(=O)O/C(=C/CC)/C1=NC(C(O1)C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H25NO5S/c1-5-7-16(25-17(21)8-6-2)18-20-19(14(4)24-18)26(22,23)15-11-9-13(3)10-12-15/h7,9-12,14,19H,5-6,8H2,1-4H3/b16-7+