(E)-3-(5-bromanyl-3-methoxy-2-propoxy-phenyl)-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-(5-bromanyl-3-methoxy-2-propoxy-phenyl)-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-(5-bromo-3-methoxy-2-propoxy-phenyl)-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-(5-bromo-3-methoxy-2-propoxyphenyl)-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-(5-bromo-3-methoxy-2-propoxyphenyl)-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-(5-bromo-3-methoxy-2-propoxy-phenyl)-2-(2-thienyl)acrylic acid Formula: C17H17BrO4S MolecularWeight: 397.28348

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C=C(C2=CC=CS2)C(=O)O)Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1/C=C(/C2=CC=CS2)\C(=O)O)Br)OC

InChI

InChI=1S/C17H17BrO4S/c1-3-6-22-16-11(8-12(18)10-14(16)21-2)9-13(17(19)20)15-5-4-7-23-15/h4-5,7-10H,3,6H2,1-2H3,(H,19,20)/b13-9-