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

Systemtic Name: 4-[5-[(E)-2-cyano-2-(2,4-dichlorophenyl)ethenyl]furan-2-yl]-3-methyl-benzoate Openeye Name: 4-[5-[(E)-2-cyano-2-(2,4-dichlorophenyl)vinyl]-2-furyl]-3-methyl-benzoate CAS Name: 4-[5-[(E)-2-cyano-2-(2,4-dichlorophenyl)ethenyl]-2-furanyl]-3-methylbenzoate IUPAC Name: 4-[5-[(E)-2-cyano-2-(2,4-dichlorophenyl)ethenyl]furan-2-yl]-3-methylbenzoate Traditional Name: 4-[5-[(E)-2-cyano-2-(2,4-dichlorophenyl)vinyl]-2-furyl]-3-methyl-benzoate Formula: C21H12Cl2NO3- MolecularWeight: 397.23088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13Cl2NO3/c1-12-8-13(21(25)26)2-5-17(12)20-7-4-16(27-20)9-14(11-24)18-6-3-15(22)10-19(18)23/h2-10H,1H3,(H,25,26)/p-1/b14-9-