(E)-3-(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-bromo-5-methoxy-4-propargyloxy-phenyl)acrylic acid Formula: C13H11BrO4 MolecularWeight: 311.12804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)O)Br)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OCC#C

InChI

InChI=1S/C13H11BrO4/c1-3-6-18-13-10(14)7-9(4-5-12(15)16)8-11(13)17-2/h1,4-5,7-8H,6H2,2H3,(H,15,16)/b5-4+