2-[(2-methyl-3-nitro-phenyl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(2-methyl-3-nitro-phenyl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(2-methyl-3-nitro-benzoyl)amino]propanoic acid CAS Name: 3-hydroxy-2-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[(2-methyl-3-nitrobenzoyl)amino]propanoic acid Traditional Name: 3-hydroxy-2-[(2-methyl-3-nitro-benzoyl)amino]propionic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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