3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-4-(2-methylpropoxy)benzoic acid

Systemtic Name: 3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-4-(2-methylpropoxy)benzoic acid Openeye Name: 3-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-4-isobutoxy-benzoic acid CAS Name: 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-4-(2-methylpropoxy)benzoic acid IUPAC Name: 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-4-(2-methylpropoxy)benzoic acid Traditional Name: 3-[(E)-3-ethoxy-3-keto-prop-1-enyl]-4-isobutoxy-benzoic acid Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C=CC(=C1)C(=O)O)OCC(C)C

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C=CC(=C1)C(=O)O)OCC(C)C

InChI

InChI=1S/C16H20O5/c1-4-20-15(17)8-6-12-9-13(16(18)19)5-7-14(12)21-10-11(2)3/h5-9,11H,4,10H2,1-3H3,(H,18,19)/b8-6+