methyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(3-fluorophenyl)-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(3-fluorophenyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-2-(chloromethyl)-5-cyano-4-(3-fluorophenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-(chloromethyl)-5-cyano-4-(3-fluorophenyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-2-(chloromethyl)-5-cyano-4-(3-fluorophenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-2-(chloromethyl)-5-cyano-4-(3-fluorophenyl)-4H-pyran-3-carboxylic acid methyl ester Formula: C15H12ClFN2O3 MolecularWeight: 322.718783

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC(=C(C1C2=CC(=CC=C2)F)C#N)N)CCl

Isomeric SMILES

COC(=O)C1=C(OC(=C(C1C2=CC(=CC=C2)F)C#N)N)CCl

InChI

InChI=1S/C15H12ClFN2O3/c1-21-15(20)13-11(6-16)22-14(19)10(7-18)12(13)8-3-2-4-9(17)5-8/h2-5,12H,6,19H2,1H3