4-[[2-chloranyl-6-ethoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-chloranyl-6-ethoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-chloro-6-ethoxy-4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[2-chloro-6-ethoxy-4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-chloro-6-ethoxy-4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-chloro-6-ethoxy-4-[(E)-3-hydroxy-3-keto-prop-1-enyl]phenoxy]methyl]benzoic acid Formula: C19H17ClO6 MolecularWeight: 376.78768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)O)Cl)OCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)O)Cl)OCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H17ClO6/c1-2-25-16-10-13(5-8-17(21)22)9-15(20)18(16)26-11-12-3-6-14(7-4-12)19(23)24/h3-10H,2,11H2,1H3,(H,21,22)(H,23,24)/b8-5+