phenacyl 4-butoxy-3-ethoxy-benzoate

Systemtic Name: phenacyl 4-butoxy-3-ethoxy-benzoate Openeye Name: phenacyl 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid phenacyl ester IUPAC Name: phenacyl 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid phenacyl ester Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)OCC

InChI

InChI=1S/C21H24O5/c1-3-5-13-25-19-12-11-17(14-20(19)24-4-2)21(23)26-15-18(22)16-9-7-6-8-10-16/h6-12,14H,3-5,13,15H2,1-2H3