ethyl 6-azanyl-4-(2-chloranyl-6-fluoranyl-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(2-chloranyl-6-fluoranyl-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(2-chloro-6-fluoro-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(2-chloro-6-fluoro-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C21H16ClFN2O3 MolecularWeight: 398.814743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC=C2Cl)F)C#N)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC=C2Cl)F)C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C21H16ClFN2O3/c1-2-27-21(26)18-16(17-14(22)9-6-10-15(17)23)13(11-24)20(25)28-19(18)12-7-4-3-5-8-12/h3-10,16H,2,25H2,1H3