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

Systemtic Name: ethyl 6-azanyl-5-cyano-4-[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodanyl-phenyl]-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodo-phenyl]-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodophenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodophenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-[3-ethoxy-4-(4-fluorobenzyl)oxy-5-iodo-phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C25H24FIN2O5 MolecularWeight: 578.371333

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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)I)OCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)I)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C25H24FIN2O5/c1-4-31-20-11-16(10-19(27)23(20)33-13-15-6-8-17(26)9-7-15)22-18(12-28)24(29)34-14(3)21(22)25(30)32-5-2/h6-11,22H,4-5,13,29H2,1-3H3