2-[[4-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]phenoxy]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[4-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]phenoxy]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[4-(3-tert-butoxy-3-oxo-propyl)phenoxy]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenoxy]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenoxy]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[4-(3-tert-butoxy-3-keto-propyl)phenoxy]methyl]-6-phenyl-benzoic acid Formula: C27H28O5 MolecularWeight: 432.50822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1=CC=C(C=C1)OCC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)CCC1=CC=C(C=C1)OCC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C27H28O5/c1-27(2,3)32-24(28)17-14-19-12-15-22(16-13-19)31-18-21-10-7-11-23(25(21)26(29)30)20-8-5-4-6-9-20/h4-13,15-16H,14,17-18H2,1-3H3,(H,29,30)