(phenylmethyl) 2-[1-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 2-[1-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-butanoate Openeye Name: benzyl 2-acetyl-3-(3,4-dimethoxyphenyl)butanoate CAS Name: 2-acetyl-3-(3,4-dimethoxyphenyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetyl-3-(3,4-dimethoxyphenyl)butanoate Traditional Name: 2-acetyl-3-(3,4-dimethoxyphenyl)butyric acid benzyl ester Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)C(C(=O)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)C(C(=O)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24O5/c1-14(17-10-11-18(24-3)19(12-17)25-4)20(15(2)22)21(23)26-13-16-8-6-5-7-9-16/h5-12,14,20H,13H2,1-4H3