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

Systemtic Name: 2-methyl-2-[(2-methyl-3-nitro-phenyl)methylcarbamoylamino]propanoic acid Openeye Name: 2-methyl-2-[(2-methyl-3-nitro-phenyl)methylcarbamoylamino]propanoic acid CAS Name: 2-methyl-2-[[[(2-methyl-3-nitrophenyl)methylamino]-oxomethyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[(2-methyl-3-nitrophenyl)methylcarbamoylamino]propanoic acid Traditional Name: 2-methyl-2-[(2-methyl-3-nitro-benzyl)carbamoylamino]propionic acid Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O5/c1-8-9(5-4-6-10(8)16(20)21)7-14-12(19)15-13(2,3)11(17)18/h4-6H,7H2,1-3H3,(H,17,18)(H2,14,15,19)