2-methyl-2-[2-(4-nitrophenyl)ethylcarbamoylamino]propanoic acid

Systemtic Name: 2-methyl-2-[2-(4-nitrophenyl)ethylcarbamoylamino]propanoic acid Openeye Name: 2-methyl-2-[2-(4-nitrophenyl)ethylcarbamoylamino]propanoic acid CAS Name: 2-methyl-2-[[[2-(4-nitrophenyl)ethylamino]-oxomethyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[2-(4-nitrophenyl)ethylcarbamoylamino]propanoic acid Traditional Name: 2-methyl-2-[2-(4-nitrophenyl)ethylcarbamoylamino]propionic acid Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)NCCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)NCCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-13(2,11(17)18)15-12(19)14-8-7-9-3-5-10(6-4-9)16(20)21/h3-6H,7-8H2,1-2H3,(H,17,18)(H2,14,15,19)