3-[4-[3-(4-ethyl-2-naphthalen-1-ylcarbonyl-phenoxy)butoxy]-2-methyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[3-(4-ethyl-2-naphthalen-1-ylcarbonyl-phenoxy)butoxy]-2-methyl-phenyl]propanoic acid Openeye Name: 3-[4-[3-[4-ethyl-2-(naphthalene-1-carbonyl)phenoxy]butoxy]-2-methyl-phenyl]propanoic acid CAS Name: 3-[4-[3-[4-ethyl-2-[1-naphthalenyl(oxo)methyl]phenoxy]butoxy]-2-methylphenyl]propanoic acid IUPAC Name: 3-[4-[3-[4-ethyl-2-(naphthalene-1-carbonyl)phenoxy]butoxy]-2-methylphenyl]propanoic acid Traditional Name: 3-[4-[3-[4-ethyl-2-(1-naphthoyl)phenoxy]butoxy]-2-methyl-phenyl]propionic acid Formula: C33H34O5 MolecularWeight: 510.62006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(C)CCOC2=CC(=C(C=C2)CCC(=O)O)C)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(C)CCOC2=CC(=C(C=C2)CCC(=O)O)C)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C33H34O5/c1-4-24-12-16-31(30(21-24)33(36)29-11-7-9-26-8-5-6-10-28(26)29)38-23(3)18-19-37-27-15-13-25(22(2)20-27)14-17-32(34)35/h5-13,15-16,20-21,23H,4,14,17-19H2,1-3H3,(H,34,35)