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

Systemtic Name: (E)-3-[3-bromanyl-5-ethoxy-4-(phenylcarbonyloxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-(4-benzoyloxy-3-bromo-5-ethoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(4-benzoyloxy-3-bromo-5-ethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-benzoyloxy-3-bromo-5-ethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-benzoyloxy-3-bromo-5-ethoxy-phenyl)acrylic acid Formula: C18H15BrO5 MolecularWeight: 391.2127

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)O)Br)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H15BrO5/c1-2-23-15-11-12(8-9-16(20)21)10-14(19)17(15)24-18(22)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H,20,21)/b9-8+