methyl 1-[5-azanyl-2,4-bis(fluoranyl)phenyl]sulfonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[5-azanyl-2,4-bis(fluoranyl)phenyl]sulfonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(5-amino-2,4-difluoro-phenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(5-amino-2,4-difluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-amino-2,4-difluorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(5-amino-2,4-difluoro-phenyl)sulfonylpyrrolidine-2-carboxylic acid methyl ester Formula: C12H14F2N2O4S MolecularWeight: 320.312366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1S(=O)(=O)C2=C(C=C(C(=C2)N)F)F

Isomeric SMILES

COC(=O)C1CCCN1S(=O)(=O)C2=C(C=C(C(=C2)N)F)F

InChI

InChI=1S/C12H14F2N2O4S/c1-20-12(17)10-3-2-4-16(10)21(18,19)11-6-9(15)7(13)5-8(11)14/h5-6,10H,2-4,15H2,1H3