2-(dimethylaminomethyl)-3,3-dimethyl-4-nitrooxy-butanoic acid

Systemtic Name: 2-(dimethylaminomethyl)-3,3-dimethyl-4-nitrooxy-butanoic acid Openeye Name: 2-(dimethylaminomethyl)-3,3-dimethyl-4-nitrooxy-butanoic acid CAS Name: 2-(dimethylaminomethyl)-3,3-dimethyl-4-nitrooxybutanoic acid IUPAC Name: 2-(dimethylaminomethyl)-3,3-dimethyl-4-nitrooxybutanoic acid Traditional Name: 2-(dimethylaminomethyl)-3,3-dimethyl-4-nitrooxy-butyric acid Formula: C9H18N2O5 MolecularWeight: 234.24962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18N2O5/c1-9(2,6-16-11(14)15)7(8(12)13)5-10(3)4/h7H,5-6H2,1-4H3,(H,12,13)