3-[2-(5-methyl-3-phenyl-hexanoyl)-4-(phenoxymethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-(5-methyl-3-phenyl-hexanoyl)-4-(phenoxymethyl)phenyl]propanoic acid Openeye Name: 3-[2-(5-methyl-3-phenyl-hexanoyl)-4-(phenoxymethyl)phenyl]propanoic acid CAS Name: 3-[2-(5-methyl-1-oxo-3-phenylhexyl)-4-(phenoxymethyl)phenyl]propanoic acid IUPAC Name: 3-[2-(5-methyl-3-phenylhexanoyl)-4-(phenoxymethyl)phenyl]propanoic acid Traditional Name: 3-[2-(5-methyl-3-phenyl-hexanoyl)-4-(phenoxymethyl)phenyl]propionic acid Formula: C29H32O4 MolecularWeight: 444.56198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C1=C(C=CC(=C1)COC2=CC=CC=C2)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(CC(=O)C1=C(C=CC(=C1)COC2=CC=CC=C2)CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C29H32O4/c1-21(2)17-25(23-9-5-3-6-10-23)19-28(30)27-18-22(13-14-24(27)15-16-29(31)32)20-33-26-11-7-4-8-12-26/h3-14,18,21,25H,15-17,19-20H2,1-2H3,(H,31,32)