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(2S)-2-[[4,5-bis(chloranyl)-2-nitro-phenyl]amino]-4-methyl-pentanoic acid

(2S)-2-[[4,5-bis(chloranyl)-2-nitro-phenyl]amino]-4-methyl-pentanoic acid

Systemtic Name:(2S)-2-[[4,5-bis(chloranyl)-2-nitro-phenyl]amino]-4-methyl-pentanoic acid
Openeye Name:(2S)-2-(4,5-dichloro-2-nitro-anilino)-4-methyl-pentanoic acid
CAS Name:(2S)-2-(4,5-dichloro-2-nitroanilino)-4-methylpentanoic acid
IUPAC Name:(2S)-2-(4,5-dichloro-2-nitroanilino)-4-methylpentanoic acid
Traditional Name:(2S)-2-(4,5-dichloro-2-nitro-anilino)-4-methyl-valeric acid
Formula: C12H14Cl2N2O4
MolecularWeight: 321.15656
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC1=CC(=C(C=C1[N+](=O)[O-])Cl)Cl


InChI

InChI=1S/C12H14Cl2N2O4/c1-6(2)3-10(12(17)18)15-9-4-7(13)8(14)5-11(9)16(19)20/h4-6,10,15H,3H2,1-2H3,(H,17,18)/t10-/m0/s1


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