4-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-butoxy-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-butoxy-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-butoxy-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-butoxy-3-keto-prop-1-enyl]benzoic acid Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCOC(=O)/C=C/C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C14H16O4/c1-2-3-10-18-13(15)9-6-11-4-7-12(8-5-11)14(16)17/h4-9H,2-3,10H2,1H3,(H,16,17)/b9-6+