3-[4-[5-[4-ethyl-2-(phenylcarbonyl)phenoxy]pentan-2-yloxy]-2-methyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[5-[4-ethyl-2-(phenylcarbonyl)phenoxy]pentan-2-yloxy]-2-methyl-phenyl]propanoic acid Openeye Name: 3-[4-[4-(2-benzoyl-4-ethyl-phenoxy)-1-methyl-butoxy]-2-methyl-phenyl]propanoic acid CAS Name: 3-[4-[5-(2-benzoyl-4-ethylphenoxy)pentan-2-yloxy]-2-methylphenyl]propanoic acid IUPAC Name: 3-[4-[5-(2-benzoyl-4-ethylphenoxy)pentan-2-yloxy]-2-methylphenyl]propanoic acid Traditional Name: 3-[4-[4-(2-benzoyl-4-ethyl-phenoxy)-1-methyl-butoxy]-2-methyl-phenyl]propionic acid Formula: C30H34O5 MolecularWeight: 474.58796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCCC(C)OC2=CC(=C(C=C2)CCC(=O)O)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCCC(C)OC2=CC(=C(C=C2)CCC(=O)O)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C30H34O5/c1-4-23-12-16-28(27(20-23)30(33)25-10-6-5-7-11-25)34-18-8-9-22(3)35-26-15-13-24(21(2)19-26)14-17-29(31)32/h5-7,10-13,15-16,19-20,22H,4,8-9,14,17-18H2,1-3H3,(H,31,32)