(E)-3-[3-bromanyl-5-ethoxy-4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-bromanyl-5-ethoxy-4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-bromo-5-ethoxy-4-(2-ethoxy-2-oxo-ethoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-bromo-5-ethoxy-4-(2-ethoxy-2-oxoethoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-bromo-5-ethoxy-4-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-bromo-5-ethoxy-4-(2-ethoxy-2-keto-ethoxy)phenyl]acrylic acid Formula: C15H17BrO6 MolecularWeight: 373.19588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)O)Br)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OCC(=O)OCC

InChI

InChI=1S/C15H17BrO6/c1-3-20-12-8-10(5-6-13(17)18)7-11(16)15(12)22-9-14(19)21-4-2/h5-8H,3-4,9H2,1-2H3,(H,17,18)/b6-5+