2-[[2,6-bis(chloranyl)-4-nitro-phenyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2,6-bis(chloranyl)-4-nitro-phenyl]amino]-3-methyl-butanoic acid Openeye Name: 2-(2,6-dichloro-4-nitro-anilino)-3-methyl-butanoic acid CAS Name: 2-(2,6-dichloro-4-nitroanilino)-3-methylbutanoic acid IUPAC Name: 2-(2,6-dichloro-4-nitroanilino)-3-methylbutanoic acid Traditional Name: 2-(2,6-dichloro-4-nitro-anilino)-3-methyl-butyric acid Formula: C11H12Cl2N2O4 MolecularWeight: 307.12998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C(C(=O)O)NC1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H12Cl2N2O4/c1-5(2)9(11(16)17)14-10-7(12)3-6(15(18)19)4-8(10)13/h3-5,9,14H,1-2H3,(H,16,17)