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

Systemtic Name: tert-butyl 6-azanyl-5-cyano-4-(3-fluorophenyl)-2-methyl-4H-pyran-3-carboxylate Openeye Name: tert-butyl 6-amino-5-cyano-4-(3-fluorophenyl)-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(3-fluorophenyl)-2-methyl-4H-pyran-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-amino-5-cyano-4-(3-fluorophenyl)-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(3-fluorophenyl)-2-methyl-4H-pyran-3-carboxylic acid tert-butyl ester Formula: C18H19FN2O3 MolecularWeight: 330.353463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19FN2O3/c1-10-14(17(22)24-18(2,3)4)15(13(9-20)16(21)23-10)11-6-5-7-12(19)8-11/h5-8,15H,21H2,1-4H3