2-methyl-4-nitro-butanoic acid

Systemtic Name: 2-methyl-4-nitro-butanoic acid Openeye Name: 2-methyl-4-nitro-butanoic acid CAS Name: 2-methyl-4-nitrobutanoic acid IUPAC Name: 2-methyl-4-nitrobutanoic acid Traditional Name: 2-methyl-4-nitro-butyric acid Formula: C5H9NO4 MolecularWeight: 147.12926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H9NO4/c1-4(5(7)8)2-3-6(9)10/h4H,2-3H2,1H3,(H,7,8)