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

Systemtic Name: (E)-3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(4-benzyloxy-3-bromo-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(3-bromo-4-phenylmethoxyphenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-4-phenylmethoxyphenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(4-benzoxy-3-bromo-phenyl)-2-cyano-acrylic acid Formula: C17H12BrNO3 MolecularWeight: 358.18608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C(C#N)C(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)O)Br

InChI

InChI=1S/C17H12BrNO3/c18-15-9-13(8-14(10-19)17(20)21)6-7-16(15)22-11-12-4-2-1-3-5-12/h1-9H,11H2,(H,20,21)/b14-8+