3-[3-butyl-2,6-ditert-butyl-4-(2-oxidanylidene-2-phenyl-ethanoyl)phenoxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-butyl-2,6-ditert-butyl-4-(2-oxidanylidene-2-phenyl-ethanoyl)phenoxy]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-butyl-2,6-ditert-butyl-4-(2-oxo-2-phenyl-acetyl)phenoxy]-3-oxo-propanoic acid CAS Name: 3-[3-butyl-2,6-ditert-butyl-4-(1,2-dioxo-2-phenylethyl)phenoxy]-3-oxopropanoic acid IUPAC Name: 3-[3-butyl-2,6-ditert-butyl-4-(2-oxo-2-phenylacetyl)phenoxy]-3-oxopropanoic acid Traditional Name: 3-[3-butyl-2,6-ditert-butyl-4-(2-keto-2-phenyl-acetyl)phenoxy]-3-keto-propionic acid Formula: C29H36O6 MolecularWeight: 480.59254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1C(=O)C(=O)C2=CC=CC=C2)C(C)(C)C)OC(=O)CC(=O)O)C(C)(C)C

Isomeric SMILES

CCCCC1=C(C(=C(C=C1C(=O)C(=O)C2=CC=CC=C2)C(C)(C)C)OC(=O)CC(=O)O)C(C)(C)C

InChI

InChI=1S/C29H36O6/c1-8-9-15-19-20(26(34)25(33)18-13-11-10-12-14-18)16-21(28(2,3)4)27(24(19)29(5,6)7)35-23(32)17-22(30)31/h10-14,16H,8-9,15,17H2,1-7H3,(H,30,31)