(2S)-2-[[3,4-bis(fluoranyl)phenyl]carbamoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[[3,4-bis(fluoranyl)phenyl]carbamoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[(3,4-difluorophenyl)carbamoylamino]-3-methyl-butanoate CAS Name: (2S)-2-[[(3,4-difluoroanilino)-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[(3,4-difluorophenyl)carbamoylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(3,4-difluorophenyl)carbamoylamino]-3-methyl-butyrate Formula: C12H13F2N2O3- MolecularWeight: 271.240026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)NC1=CC(=C(C=C1)F)F

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)NC1=CC(=C(C=C1)F)F

InChI

InChI=1S/C12H14F2N2O3/c1-6(2)10(11(17)18)16-12(19)15-7-3-4-8(13)9(14)5-7/h3-6,10H,1-2H3,(H,17,18)(H2,15,16,19)/p-1/t10-/m0/s1