(E)-3-[3-bromanyl-5-[(E)-3-(2-phenylmethoxyphenyl)prop-2-enyl]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[3-bromanyl-5-[(E)-3-(2-phenylmethoxyphenyl)prop-2-enyl]phenyl]prop-2-enoate Openeye Name: (E)-3-[3-[(E)-3-(2-benzyloxyphenyl)allyl]-5-bromo-phenyl]prop-2-enoate CAS Name: (E)-3-[3-bromo-5-[(E)-3-(2-phenylmethoxyphenyl)prop-2-enyl]phenyl]-2-propenoate IUPAC Name: (E)-3-[3-bromo-5-[(E)-3-(2-phenylmethoxyphenyl)prop-2-enyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[(E)-3-(2-benzoxyphenyl)allyl]-5-bromo-phenyl]acrylate Formula: C25H20BrO3- MolecularWeight: 448.3285

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C=CCC3=CC(=CC(=C3)C=CC(=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2/C=C/CC3=CC(=CC(=C3)/C=C/C(=O)[O-])Br

InChI

InChI=1S/C25H21BrO3/c26-23-16-20(15-21(17-23)13-14-25(27)28)9-6-11-22-10-4-5-12-24(22)29-18-19-7-2-1-3-8-19/h1-8,10-17H,9,18H2,(H,27,28)/p-1/b11-6+,14-13+