2-[(E)-2-(4-benzo[e][1]benzofuran-2-yl-2-propyl-phenyl)ethenyl]-4-methoxy-benzoic acid

Systemtic Name: 2-[(E)-2-(4-benzo[e][1]benzofuran-2-yl-2-propyl-phenyl)ethenyl]-4-methoxy-benzoic acid Openeye Name: 2-[(E)-2-(4-benzo[e]benzofuran-2-yl-2-propyl-phenyl)vinyl]-4-methoxy-benzoic acid CAS Name: 2-[(E)-2-[4-(2-benzo[e]benzofuranyl)-2-propylphenyl]ethenyl]-4-methoxybenzoic acid IUPAC Name: 2-[(E)-2-(4-benzo[e][1]benzofuran-2-yl-2-propylphenyl)ethenyl]-4-methoxybenzoic acid Traditional Name: 2-[(E)-2-(4-benzo[e]benzofuran-2-yl-2-propyl-phenyl)vinyl]-4-methoxy-benzoic acid Formula: C31H26O4 MolecularWeight: 462.53574

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C2=CC3=C(O2)C=CC4=CC=CC=C43)C=CC5=C(C=CC(=C5)OC)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2=CC3=C(O2)C=CC4=CC=CC=C43)/C=C/C5=C(C=CC(=C5)OC)C(=O)O

InChI

InChI=1S/C31H26O4/c1-3-6-22-17-24(30-19-28-26-8-5-4-7-21(26)13-16-29(28)35-30)12-10-20(22)9-11-23-18-25(34-2)14-15-27(23)31(32)33/h4-5,7-19H,3,6H2,1-2H3,(H,32,33)/b11-9+