2-methyl-2-[(4-nitrophenyl)amino]pentanoic acid

Systemtic Name: 2-methyl-2-[(4-nitrophenyl)amino]pentanoic acid Openeye Name: 2-methyl-2-(4-nitroanilino)pentanoic acid CAS Name: 2-methyl-2-(4-nitroanilino)pentanoic acid IUPAC Name: 2-methyl-2-(4-nitroanilino)pentanoic acid Traditional Name: 2-methyl-2-(4-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=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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