[4-[2-cyano-3-[(2-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] 4-methoxybenzoate

Systemtic Name: [4-[2-cyano-3-[(2-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] 4-methoxybenzoate Openeye Name: [4-[2-cyano-3-(2-fluoroanilino)-3-oxo-prop-1-enyl]-2-ethoxy-phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-[2-cyano-3-(2-fluoroanilino)-3-oxoprop-1-enyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-(2-fluoroanilino)-3-oxoprop-1-enyl]-2-ethoxyphenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-[2-cyano-3-(2-fluoroanilino)-3-keto-prop-1-enyl]-2-ethoxy-phenyl] ester Formula: C26H21FN2O5 MolecularWeight: 460.453743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2F)OC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2F)OC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H21FN2O5/c1-3-33-24-15-17(14-19(16-28)25(30)29-22-7-5-4-6-21(22)27)8-13-23(24)34-26(31)18-9-11-20(32-2)12-10-18/h4-15H,3H2,1-2H3,(H,29,30)