ethyl 4-[5-[3-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[3-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[3-(4-bromo-2-fluoro-anilino)-2-cyano-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[3-(4-bromo-2-fluoroanilino)-2-cyano-3-oxoprop-1-enyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[3-(4-bromo-2-fluoroanilino)-2-cyano-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[3-(4-bromo-2-fluoro-anilino)-2-cyano-3-keto-prop-1-enyl]-2-furyl]benzoic acid ethyl ester Formula: C23H16BrFN2O4 MolecularWeight: 483.286543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C23H16BrFN2O4/c1-2-30-23(29)15-5-3-14(4-6-15)21-10-8-18(31-21)11-16(13-26)22(28)27-20-9-7-17(24)12-19(20)25/h3-12H,2H2,1H3,(H,27,28)