butyl 2-methyl-2-oxidanyl-propanoate; nitromethane

Systemtic Name: butyl 2-methyl-2-oxidanyl-propanoate; nitromethane Openeye Name: butyl 2-hydroxy-2-methyl-propanoate; nitromethane CAS Name: 2-hydroxy-2-methylpropanoic acid butyl ester; nitromethane IUPAC Name: butyl 2-hydroxy-2-methylpropanoate; nitromethane Traditional Name: 2-hydroxy-2-methyl-propionic acid butyl ester; nitromethane Formula: C9H19NO5 MolecularWeight: 221.25086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C)O.C[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C(C)(C)O.C[N+](=O)[O-]

InChI

InChI=1S/C8H16O3.CH3NO2/c1-4-5-6-11-7(9)8(2,3)10;1-2(3)4/h10H,4-6H2,1-3H3;1H3