(E)-3-(3,4-dimethoxyphenyl)sulfanyl-3-phenyl-prop-2-enoic acid

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)sulfanyl-3-phenyl-prop-2-enoic acid Openeye Name: (E)-3-(3,4-dimethoxyphenyl)sulfanyl-3-phenyl-prop-2-enoic acid CAS Name: (E)-3-[(3,4-dimethoxyphenyl)thio]-3-phenyl-2-propenoic acid IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)sulfanyl-3-phenylprop-2-enoic acid Traditional Name: (E)-3-[(3,4-dimethoxyphenyl)thio]-3-phenyl-acrylic acid Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SC(=CC(=O)O)C2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S/C(=C/C(=O)O)/C2=CC=CC=C2)OC

InChI

InChI=1S/C17H16O4S/c1-20-14-9-8-13(10-15(14)21-2)22-16(11-17(18)19)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,18,19)/b16-11+