2-[(3,5-dimethyl-4-nitro-phenyl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(3,5-dimethyl-4-nitro-phenyl)carbonylamino]ethanoic acid Openeye Name: 2-[(3,5-dimethyl-4-nitro-benzoyl)amino]acetic acid CAS Name: 2-[[(3,5-dimethyl-4-nitrophenyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(3,5-dimethyl-4-nitrobenzoyl)amino]acetic acid Traditional Name: 2-[(3,5-dimethyl-4-nitro-benzoyl)amino]acetic acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c1-6-3-8(11(16)12-5-9(14)15)4-7(2)10(6)13(17)18/h3-4H,5H2,1-2H3,(H,12,16)(H,14,15)