4-[(E)-3-[(4-carboxyphenyl)methyl]-5-[2-[(4-phenethylphenyl)methoxy]phenyl]pent-4-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-[(4-carboxyphenyl)methyl]-5-[2-[(4-phenethylphenyl)methoxy]phenyl]pent-4-enyl]benzoic acid Openeye Name: 4-[(E)-3-[(4-carboxyphenyl)methyl]-5-[2-[(4-phenethylphenyl)methoxy]phenyl]pent-4-enyl]benzoic acid CAS Name: 4-[(E)-3-[(4-carboxyphenyl)methyl]-5-[2-[(4-phenethylphenyl)methoxy]phenyl]pent-4-enyl]benzoic acid IUPAC Name: 4-[(E)-3-[(4-carboxyphenyl)methyl]-5-[2-[(4-phenethylphenyl)methoxy]phenyl]pent-4-enyl]benzoic acid Traditional Name: 4-[(E)-3-(4-carboxybenzyl)-5-[2-(4-phenethylbenzyl)oxyphenyl]pent-4-enyl]benzoic acid Formula: C41H38O5 MolecularWeight: 610.73742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=C(C=C2)COC3=CC=CC=C3C=CC(CCC4=CC=C(C=C4)C(=O)O)CC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=C(C=C2)COC3=CC=CC=C3/C=C/C(CCC4=CC=C(C=C4)C(=O)O)CC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C41H38O5/c42-40(43)37-24-18-32(19-25-37)12-15-33(28-34-21-26-38(27-22-34)41(44)45)20-23-36-8-4-5-9-39(36)46-29-35-16-13-31(14-17-35)11-10-30-6-2-1-3-7-30/h1-9,13-14,16-27,33H,10-12,15,28-29H2,(H,42,43)(H,44,45)/b23-20+