4-[3-[5-(2-methylpropanoyl)-2-phenylmethoxy-phenyl]propyl]benzoic acid

Systemtic Name: 4-[3-[5-(2-methylpropanoyl)-2-phenylmethoxy-phenyl]propyl]benzoic acid Openeye Name: 4-[3-[2-benzyloxy-5-(2-methylpropanoyl)phenyl]propyl]benzoic acid CAS Name: 4-[3-[5-(2-methyl-1-oxopropyl)-2-phenylmethoxyphenyl]propyl]benzoic acid IUPAC Name: 4-[3-[5-(2-methylpropanoyl)-2-phenylmethoxyphenyl]propyl]benzoic acid Traditional Name: 4-[3-(2-benzoxy-5-isobutyryl-phenyl)propyl]benzoic acid Formula: C27H28O4 MolecularWeight: 416.50882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)C(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C27H28O4/c1-19(2)26(28)24-15-16-25(31-18-21-7-4-3-5-8-21)23(17-24)10-6-9-20-11-13-22(14-12-20)27(29)30/h3-5,7-8,11-17,19H,6,9-10,18H2,1-2H3,(H,29,30)