4-[(E)-3-(2-chloranyl-4,5-dimethoxy-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-(2-chloranyl-4,5-dimethoxy-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(2-chloro-4,5-dimethoxy-phenyl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(2-chloro-4,5-dimethoxyphenyl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(2-chloro-4,5-dimethoxyphenyl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(2-chloro-4,5-dimethoxy-phenyl)-3-keto-prop-1-enyl]benzoic acid Formula: C18H15ClO5 MolecularWeight: 346.7617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)/C=C/C2=CC=C(C=C2)C(=O)O)Cl)OC

InChI

InChI=1S/C18H15ClO5/c1-23-16-9-13(14(19)10-17(16)24-2)15(20)8-5-11-3-6-12(7-4-11)18(21)22/h3-10H,1-2H3,(H,21,22)/b8-5+