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2-[methanoyl-(3-methyl-2-nitro-phenyl)amino]-3-methyl-butanoic acid

2-[methanoyl-(3-methyl-2-nitro-phenyl)amino]-3-methyl-butanoic acid

Systemtic Name:2-[methanoyl-(3-methyl-2-nitro-phenyl)amino]-3-methyl-butanoic acid
Openeye Name:2-(N-formyl-3-methyl-2-nitro-anilino)-3-methyl-butanoic acid
CAS Name:2-(N-formyl-3-methyl-2-nitroanilino)-3-methylbutanoic acid
IUPAC Name:2-(N-formyl-3-methyl-2-nitroanilino)-3-methylbutanoic acid
Traditional Name:2-(N-formyl-3-methyl-2-nitro-anilino)-3-methyl-butyric acid
Formula: C13H16N2O5
MolecularWeight: 280.27654
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C=O)C(C(C)C)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

CC1=C(C(=CC=C1)N(C=O)C(C(C)C)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C13H16N2O5/c1-8(2)11(13(17)18)14(7-16)10-6-4-5-9(3)12(10)15(19)20/h4-8,11H,1-3H3,(H,17,18)


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