3-[5-[(E)-2-(4-chlorophenyl)-2-cyano-ethenyl]furan-2-yl]-4-methyl-benzoate

Systemtic Name: 3-[5-[(E)-2-(4-chlorophenyl)-2-cyano-ethenyl]furan-2-yl]-4-methyl-benzoate Openeye Name: 3-[5-[(E)-2-(4-chlorophenyl)-2-cyano-vinyl]-2-furyl]-4-methyl-benzoate CAS Name: 3-[5-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-furanyl]-4-methylbenzoate IUPAC Name: 3-[5-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]furan-2-yl]-4-methylbenzoate Traditional Name: 3-[5-[(E)-2-(4-chlorophenyl)-2-cyano-vinyl]-2-furyl]-4-methyl-benzoate Formula: C21H13ClNO3- MolecularWeight: 362.78582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])C2=CC=C(O2)/C=C(/C#N)\C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H14ClNO3/c1-13-2-3-15(21(24)25)11-19(13)20-9-8-18(26-20)10-16(12-23)14-4-6-17(22)7-5-14/h2-11H,1H3,(H,24,25)/p-1/b16-10-