2-[(2-chloranyl-4-nitro-phenyl)amino]-2-methyl-pentanoic acid

Systemtic Name: 2-[(2-chloranyl-4-nitro-phenyl)amino]-2-methyl-pentanoic acid Openeye Name: 2-(2-chloro-4-nitro-anilino)-2-methyl-pentanoic acid CAS Name: 2-(2-chloro-4-nitroanilino)-2-methylpentanoic acid IUPAC Name: 2-(2-chloro-4-nitroanilino)-2-methylpentanoic acid Traditional Name: 2-(2-chloro-4-nitro-anilino)-2-methyl-valeric acid Formula: C12H15ClN2O4 MolecularWeight: 286.7115

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O4/c1-3-6-12(2,11(16)17)14-10-5-4-8(15(18)19)7-9(10)13/h4-5,7,14H,3,6H2,1-2H3,(H,16,17)