2-[[2,4-bis(fluoranyl)-5-nitro-phenyl]carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2,4-bis(fluoranyl)-5-nitro-phenyl]carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(2,4-difluoro-5-nitro-benzoyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(2,4-difluoro-5-nitrophenyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(2,4-difluoro-5-nitrobenzoyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(2,4-difluoro-5-nitro-benzoyl)amino]-3-methyl-butyric acid Formula: C12H12F2N2O5 MolecularWeight: 302.230886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H12F2N2O5/c1-5(2)10(12(18)19)15-11(17)6-3-9(16(20)21)8(14)4-7(6)13/h3-5,10H,1-2H3,(H,15,17)(H,18,19)