3-[4-(3-phenylmethoxyprop-1-ynyl)phenyl]carbonylpentanoic acid

Systemtic Name: 3-[4-(3-phenylmethoxyprop-1-ynyl)phenyl]carbonylpentanoic acid Openeye Name: 3-[4-(3-benzyloxyprop-1-ynyl)benzoyl]pentanoic acid CAS Name: 3-[oxo-[4-(3-phenylmethoxyprop-1-ynyl)phenyl]methyl]pentanoic acid IUPAC Name: 3-[4-(3-phenylmethoxyprop-1-ynyl)benzoyl]pentanoic acid Traditional Name: 3-[4-(3-benzoxyprop-1-ynyl)benzoyl]valeric acid Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)C(=O)C1=CC=C(C=C1)C#CCOCC2=CC=CC=C2

Isomeric SMILES

CCC(CC(=O)O)C(=O)C1=CC=C(C=C1)C#CCOCC2=CC=CC=C2

InChI

InChI=1S/C22H22O4/c1-2-19(15-21(23)24)22(25)20-12-10-17(11-13-20)9-6-14-26-16-18-7-4-3-5-8-18/h3-5,7-8,10-13,19H,2,14-16H2,1H3,(H,23,24)