[1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 4-ethoxy-3-methoxy-benzoate

Systemtic Name: [1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 4-ethoxy-3-methoxy-benzoate Openeye Name: [2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] 4-ethoxy-3-methoxy-benzoate CAS Name: 4-ethoxy-3-methoxybenzoic acid [1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] 4-ethoxy-3-methoxybenzoate Traditional Name: 4-ethoxy-3-methoxy-benzoic acid [2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)C2=C(C=CC(=C2)C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)C2=C(C=CC(=C2)C)C)OC

InChI

InChI=1S/C21H24O5/c1-6-25-18-10-9-16(12-19(18)24-5)21(23)26-15(4)20(22)17-11-13(2)7-8-14(17)3/h7-12,15H,6H2,1-5H3