2-formamido-2-methyl-3-(3-nitro-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2-formamido-2-methyl-3-(3-nitro-4-oxidanyl-phenyl)propanoic acid Openeye Name: 2-formamido-3-(4-hydroxy-3-nitro-phenyl)-2-methyl-propanoic acid CAS Name: 2-formamido-3-(4-hydroxy-3-nitrophenyl)-2-methylpropanoic acid IUPAC Name: 2-formamido-3-(4-hydroxy-3-nitrophenyl)-2-methylpropanoic acid Traditional Name: 2-formamido-3-(4-hydroxy-3-nitro-phenyl)-2-methyl-propionic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)O)[N+](=O)[O-])(C(=O)O)NC=O

Isomeric SMILES

CC(CC1=CC(=C(C=C1)O)[N+](=O)[O-])(C(=O)O)NC=O

InChI

InChI=1S/C11H12N2O6/c1-11(10(16)17,12-6-14)5-7-2-3-9(15)8(4-7)13(18)19/h2-4,6,15H,5H2,1H3,(H,12,14)(H,16,17)