2-[(2E,4E)-hexa-2,4-dienoyl]sulfanylethyl (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: 2-[(2E,4E)-hexa-2,4-dienoyl]sulfanylethyl (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: 2-[(2E,4E)-hexa-2,4-dienoyl]sulfanylethyl (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid 2-[[(2E,4E)-1-oxohexa-2,4-dienyl]thio]ethyl ester IUPAC Name: 2-[(2E,4E)-hexa-2,4-dienoyl]sulfanylethyl (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid 2-[[(2E,4E)-hexa-2,4-dienoyl]thio]ethyl ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)SCCOC(=O)C=CC1=CC=C(C=C1)OC

Isomeric SMILES

C/C=C/C=C/C(=O)SCCOC(=O)/C=C/C1=CC=C(C=C1)OC

InChI

InChI=1S/C18H20O4S/c1-3-4-5-6-18(20)23-14-13-22-17(19)12-9-15-7-10-16(21-2)11-8-15/h3-12H,13-14H2,1-2H3/b4-3+,6-5+,12-9+