2-(4-butoxy-3-methoxy-phenyl)ethanoate

Systemtic Name: 2-(4-butoxy-3-methoxy-phenyl)ethanoate Openeye Name: 2-(4-butoxy-3-methoxy-phenyl)acetate CAS Name: 2-(4-butoxy-3-methoxyphenyl)acetate IUPAC Name: 2-(4-butoxy-3-methoxyphenyl)acetate Traditional Name: 2-(4-butoxy-3-methoxy-phenyl)acetate Formula: C13H17O4- MolecularWeight: 237.27168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CC(=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CC(=O)[O-])OC

InChI

InChI=1S/C13H18O4/c1-3-4-7-17-11-6-5-10(9-13(14)15)8-12(11)16-2/h5-6,8H,3-4,7,9H2,1-2H3,(H,14,15)/p-1