2-[(2-methyl-6-nitro-phenyl)carbonylamino]propanoic acid

Systemtic Name: 2-[(2-methyl-6-nitro-phenyl)carbonylamino]propanoic acid Openeye Name: 2-[(2-methyl-6-nitro-benzoyl)amino]propanoic acid CAS Name: 2-[[(2-methyl-6-nitrophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(2-methyl-6-nitrobenzoyl)amino]propanoic acid Traditional Name: 2-[(2-methyl-6-nitro-benzoyl)amino]propionic acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c1-6-4-3-5-8(13(17)18)9(6)10(14)12-7(2)11(15)16/h3-5,7H,1-2H3,(H,12,14)(H,15,16)