2-[2-[4-[4-(3-acetyloxyprop-1-ynyl)phenyl]phenyl]-2-oxidanylidene-ethyl]-5-phenyl-pentanoic acid

Systemtic Name: 2-[2-[4-[4-(3-acetyloxyprop-1-ynyl)phenyl]phenyl]-2-oxidanylidene-ethyl]-5-phenyl-pentanoic acid Openeye Name: 2-[2-[4-[4-(3-acetoxyprop-1-ynyl)phenyl]phenyl]-2-oxo-ethyl]-5-phenyl-pentanoic acid CAS Name: 2-[2-[4-[4-(3-acetyloxyprop-1-ynyl)phenyl]phenyl]-2-oxoethyl]-5-phenylpentanoic acid IUPAC Name: 2-[2-[4-[4-(3-acetyloxyprop-1-ynyl)phenyl]phenyl]-2-oxoethyl]-5-phenylpentanoic acid Traditional Name: 2-[2-[4-[4-(3-acetoxyprop-1-ynyl)phenyl]phenyl]-2-keto-ethyl]-5-phenyl-valeric acid Formula: C30H28O5 MolecularWeight: 468.54032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC#CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CC(CCCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(=O)OCC#CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CC(CCCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C30H28O5/c1-22(31)35-20-6-10-24-12-14-25(15-13-24)26-16-18-27(19-17-26)29(32)21-28(30(33)34)11-5-9-23-7-3-2-4-8-23/h2-4,7-8,12-19,28H,5,9,11,20-21H2,1H3,(H,33,34)