2-[(4-methyl-3-nitro-phenyl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(4-methyl-3-nitro-phenyl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(4-methyl-3-nitro-benzoyl)amino]propanoic acid CAS Name: 3-hydroxy-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[(4-methyl-3-nitrobenzoyl)amino]propanoic acid Traditional Name: 3-hydroxy-2-[(4-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=C(C=C1)C(=O)NC(CO)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O6/c1-6-2-3-7(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)