2-[3-ethyl-4-[2-[4-(1-phenylmethoxycyclopropyl)phenyl]ethynyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-ethyl-4-[2-[4-(1-phenylmethoxycyclopropyl)phenyl]ethynyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-[4-(1-benzyloxycyclopropyl)phenyl]ethynyl]-3-ethyl-phenyl]acetic acid CAS Name: 2-[3-ethyl-4-[2-[4-(1-phenylmethoxycyclopropyl)phenyl]ethynyl]phenyl]acetic acid IUPAC Name: 2-[3-ethyl-4-[2-[4-(1-phenylmethoxycyclopropyl)phenyl]ethynyl]phenyl]acetic acid Traditional Name: 2-[4-[2-[4-(1-benzoxycyclopropyl)phenyl]ethynyl]-3-ethyl-phenyl]acetic acid Formula: C28H26O3 MolecularWeight: 410.50424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)CC(=O)O)C#CC2=CC=C(C=C2)C3(CC3)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=CC(=C1)CC(=O)O)C#CC2=CC=C(C=C2)C3(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H26O3/c1-2-24-18-23(19-27(29)30)9-13-25(24)12-8-21-10-14-26(15-11-21)28(16-17-28)31-20-22-6-4-3-5-7-22/h3-7,9-11,13-15,18H,2,16-17,19-20H2,1H3,(H,29,30)