methyl 4-[3,5-dimethyl-4-(2-oxidanylideneethoxy)phenyl]-2-propan-2-yl-benzoate

Systemtic Name: methyl 4-[3,5-dimethyl-4-(2-oxidanylideneethoxy)phenyl]-2-propan-2-yl-benzoate Openeye Name: methyl 4-[3,5-dimethyl-4-(2-oxoethoxy)phenyl]-2-isopropyl-benzoate CAS Name: 4-[3,5-dimethyl-4-(2-oxoethoxy)phenyl]-2-propan-2-ylbenzoic acid methyl ester IUPAC Name: methyl 4-[3,5-dimethyl-4-(2-oxoethoxy)phenyl]-2-propan-2-ylbenzoate Traditional Name: 2-isopropyl-4-[4-(2-ketoethoxy)-3,5-dimethyl-phenyl]benzoic acid methyl ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC=O)C)C2=CC(=C(C=C2)C(=O)OC)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1OCC=O)C)C2=CC(=C(C=C2)C(=O)OC)C(C)C

InChI

InChI=1S/C21H24O4/c1-13(2)19-12-16(6-7-18(19)21(23)24-5)17-10-14(3)20(15(4)11-17)25-9-8-22/h6-8,10-13H,9H2,1-5H3