3-(3-methoxy-3-oxidanylidene-propyl)-4-(2-methylpropoxy)benzoate

Systemtic Name: 3-(3-methoxy-3-oxidanylidene-propyl)-4-(2-methylpropoxy)benzoate Openeye Name: 4-isobutoxy-3-(3-methoxy-3-oxo-propyl)benzoate CAS Name: 3-(3-methoxy-3-oxopropyl)-4-(2-methylpropoxy)benzoate IUPAC Name: 3-(3-methoxy-3-oxopropyl)-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-(3-keto-3-methoxy-propyl)benzoate Formula: C15H19O5- MolecularWeight: 279.30836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)[O-])CCC(=O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)[O-])CCC(=O)OC

InChI

InChI=1S/C15H20O5/c1-10(2)9-20-13-6-4-12(15(17)18)8-11(13)5-7-14(16)19-3/h4,6,8,10H,5,7,9H2,1-3H3,(H,17,18)/p-1