methyl 6-[(E)-4-methoxy-2-(4-methylphenyl)sulfinyl-4-oxidanylidene-but-2-enoxy]hex-2-ynoate

Systemtic Name: methyl 6-[(E)-4-methoxy-2-(4-methylphenyl)sulfinyl-4-oxidanylidene-but-2-enoxy]hex-2-ynoate Openeye Name: methyl 6-[(E)-4-methoxy-4-oxo-2-(p-tolylsulfinyl)but-2-enoxy]hex-2-ynoate CAS Name: 6-[(E)-4-methoxy-2-(4-methylphenyl)sulfinyl-4-oxobut-2-enoxy]-2-hexynoic acid methyl ester IUPAC Name: methyl 6-[(E)-4-methoxy-2-(4-methylphenyl)sulfinyl-4-oxobut-2-enoxy]hex-2-ynoate Traditional Name: 6-[(E)-4-keto-4-methoxy-2-(p-tolylsulfinyl)but-2-enoxy]hex-2-ynoic acid methyl ester Formula: C19H22O6S MolecularWeight: 378.43938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(=CC(=O)OC)COCCCC#CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)/C(=C/C(=O)OC)/COCCCC#CC(=O)OC

InChI

InChI=1S/C19H22O6S/c1-15-8-10-16(11-9-15)26(22)17(13-19(21)24-3)14-25-12-6-4-5-7-18(20)23-2/h8-11,13H,4,6,12,14H2,1-3H3/b17-13+