(E)-3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(4-benzyloxy-3-bromo-5-ethoxy-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(4-benzoxy-3-bromo-5-ethoxy-phenyl)-2-cyano-acrylic acid Formula: C19H16BrNO4 MolecularWeight: 402.23864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)O)Br)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)O)Br)OCC2=CC=CC=C2

InChI

InChI=1S/C19H16BrNO4/c1-2-24-17-10-14(8-15(11-21)19(22)23)9-16(20)18(17)25-12-13-6-4-3-5-7-13/h3-10H,2,12H2,1H3,(H,22,23)/b15-8+