3-methylbutyl 3-(2,6-dimethylphenyl)-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: 3-methylbutyl 3-(2,6-dimethylphenyl)-3-oxidanylidene-2-phenyl-propanoate Openeye Name: isopentyl 3-(2,6-dimethylphenyl)-3-oxo-2-phenyl-propanoate CAS Name: 3-(2,6-dimethylphenyl)-3-oxo-2-phenylpropanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-(2,6-dimethylphenyl)-3-oxo-2-phenylpropanoate Traditional Name: 3-(2,6-dimethylphenyl)-3-keto-2-phenyl-propionic acid isoamyl ester Formula: C22H26O3 MolecularWeight: 338.44004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)C(C2=CC=CC=C2)C(=O)OCCC(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)C(C2=CC=CC=C2)C(=O)OCCC(C)C

InChI

InChI=1S/C22H26O3/c1-15(2)13-14-25-22(24)20(18-11-6-5-7-12-18)21(23)19-16(3)9-8-10-17(19)4/h5-12,15,20H,13-14H2,1-4H3