propan-2-yl 2-[(E)-2-(4-benzo[g][1]benzofuran-2-yl-2-propyl-phenyl)ethenyl]-5-iodanyl-benzoate

Systemtic Name: propan-2-yl 2-[(E)-2-(4-benzo[g][1]benzofuran-2-yl-2-propyl-phenyl)ethenyl]-5-iodanyl-benzoate Openeye Name: isopropyl 2-[(E)-2-(4-benzo[g]benzofuran-2-yl-2-propyl-phenyl)vinyl]-5-iodo-benzoate CAS Name: 2-[(E)-2-[4-(2-benzo[g]benzofuranyl)-2-propylphenyl]ethenyl]-5-iodobenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(E)-2-(4-benzo[g][1]benzofuran-2-yl-2-propylphenyl)ethenyl]-5-iodobenzoate Traditional Name: 2-[(E)-2-(4-benzo[g]benzofuran-2-yl-2-propyl-phenyl)vinyl]-5-iodo-benzoic acid isopropyl ester Formula: C33H29IO3 MolecularWeight: 600.48603

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C2=CC3=C(O2)C4=CC=CC=C4C=C3)C=CC5=C(C=C(C=C5)I)C(=O)OC(C)C

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2=CC3=C(O2)C4=CC=CC=C4C=C3)/C=C/C5=C(C=C(C=C5)I)C(=O)OC(C)C

InChI

InChI=1S/C33H29IO3/c1-4-7-25-18-26(31-19-27-15-13-23-8-5-6-9-29(23)32(27)37-31)14-11-22(25)10-12-24-16-17-28(34)20-30(24)33(35)36-21(2)3/h5-6,8-21H,4,7H2,1-3H3/b12-10+