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(E)-3-(3-methoxy-4-propoxy-phenyl)-2-sulfanyl-prop-2-enoic acid

(E)-3-(3-methoxy-4-propoxy-phenyl)-2-sulfanyl-prop-2-enoic acid

Systemtic Name:(E)-3-(3-methoxy-4-propoxy-phenyl)-2-sulfanyl-prop-2-enoic acid
Openeye Name:(E)-3-(3-methoxy-4-propoxy-phenyl)-2-sulfanyl-prop-2-enoic acid
CAS Name:(E)-2-mercapto-3-(3-methoxy-4-propoxyphenyl)-2-propenoic acid
IUPAC Name:(E)-3-(3-methoxy-4-propoxyphenyl)-2-sulfanylprop-2-enoic acid
Traditional Name:(E)-2-mercapto-3-(3-methoxy-4-propoxy-phenyl)acrylic acid
Formula: C13H16O4S
MolecularWeight: 268.32874
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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C(C(=O)O)S)OC


Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C(\C(=O)O)/S)OC


InChI

InChI=1S/C13H16O4S/c1-3-6-17-10-5-4-9(7-11(10)16-2)8-12(18)13(14)15/h4-5,7-8,18H,3,6H2,1-2H3,(H,14,15)/b12-8+


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