ethyl 6-azanyl-5-cyano-4-[3-ethoxy-4-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-4-[3-ethoxy-4-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-[2-(4-fluoroanilino)-2-oxo-ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[3-ethoxy-4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-[3-ethoxy-4-[2-(4-fluoroanilino)-2-keto-ethoxy]phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C26H26FN3O6 MolecularWeight: 495.499543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)OCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)OCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C26H26FN3O6/c1-4-33-21-12-16(24-19(13-28)25(29)36-15(3)23(24)26(32)34-5-2)6-11-20(21)35-14-22(31)30-18-9-7-17(27)8-10-18/h6-12,24H,4-5,14,29H2,1-3H3,(H,30,31)