2-[[2-methoxy-5-[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[2-methoxy-5-[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-[(E)-3-(4-allyloxy-3-methoxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[2-methoxy-5-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-1-oxoprop-2-enyl]phenyl]methylthio]acetic acid IUPAC Name: 2-[[2-methoxy-5-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-[(E)-3-(4-allyloxy-3-methoxy-phenyl)acryloyl]-2-methoxy-benzyl]thio]acetic acid Formula: C23H24O6S MolecularWeight: 428.49806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OCC=C)OC)CSCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)OCC=C)OC)CSCC(=O)O

InChI

InChI=1S/C23H24O6S/c1-4-11-29-21-9-6-16(12-22(21)28-3)5-8-19(24)17-7-10-20(27-2)18(13-17)14-30-15-23(25)26/h4-10,12-13H,1,11,14-15H2,2-3H3,(H,25,26)/b8-5+