[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,5-dimethoxyphenyl)-2-propenoic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2,5-dimethoxyphenyl)acrylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C21H22O5S2 MolecularWeight: 418.52638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)OC2=C(C=C(C=C2)C3SCCS3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)/C=C/C(=O)OC2=C(C=C(C=C2)C3SCCS3)OC

InChI

InChI=1S/C21H22O5S2/c1-23-16-6-8-17(24-2)14(12-16)5-9-20(22)26-18-7-4-15(13-19(18)25-3)21-27-10-11-28-21/h4-9,12-13,21H,10-11H2,1-3H3/b9-5+