2-methyl-2-[(2-nitrophenyl)amino]pentanoic acid

Systemtic Name: 2-methyl-2-[(2-nitrophenyl)amino]pentanoic acid Openeye Name: 2-methyl-2-(2-nitroanilino)pentanoic acid CAS Name: 2-methyl-2-(2-nitroanilino)pentanoic acid IUPAC Name: 2-methyl-2-(2-nitroanilino)pentanoic acid Traditional Name: 2-methyl-2-(2-nitroanilino)valeric acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCCC(C)(C(=O)O)NC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-3-8-12(2,11(15)16)13-9-6-4-5-7-10(9)14(17)18/h4-7,13H,3,8H2,1-2H3,(H,15,16)