(phenylmethyl) 6-azanyl-4-[2,4-bis(fluoranyl)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: (phenylmethyl) 6-azanyl-4-[2,4-bis(fluoranyl)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: benzyl 6-amino-5-cyano-4-(2,4-difluorophenyl)-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(2,4-difluorophenyl)-2-methyl-4H-pyran-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-amino-5-cyano-4-(2,4-difluorophenyl)-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(2,4-difluorophenyl)-2-methyl-4H-pyran-3-carboxylic acid benzyl ester Formula: C21H16F2N2O3 MolecularWeight: 382.360146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N)C#N)C2=C(C=C(C=C2)F)F)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(C(=C(O1)N)C#N)C2=C(C=C(C=C2)F)F)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H16F2N2O3/c1-12-18(21(26)27-11-13-5-3-2-4-6-13)19(16(10-24)20(25)28-12)15-8-7-14(22)9-17(15)23/h2-9,19H,11,25H2,1H3