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

Systemtic Name: (phenylmethyl) 2-azanyl-4-[2,5-bis(fluoranyl)phenyl]-5-cyano-6-methyl-4H-pyran-3-carboxylate Openeye Name: benzyl 2-amino-5-cyano-4-(2,5-difluorophenyl)-6-methyl-4H-pyran-3-carboxylate CAS Name: 2-amino-5-cyano-4-(2,5-difluorophenyl)-6-methyl-4H-pyran-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-5-cyano-4-(2,5-difluorophenyl)-6-methyl-4H-pyran-3-carboxylate Traditional Name: 2-amino-5-cyano-4-(2,5-difluorophenyl)-6-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(=O)OCC2=CC=CC=C2)C3=C(C=CC(=C3)F)F)C#N

Isomeric SMILES

CC1=C(C(C(=C(O1)N)C(=O)OCC2=CC=CC=C2)C3=C(C=CC(=C3)F)F)C#N

InChI

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