2-chloranyl-1-nitro-propane; tris(chloranyl)-nitro-methane

Systemtic Name: 2-chloranyl-1-nitro-propane; tris(chloranyl)-nitro-methane Openeye Name: 2-chloro-1-nitro-propane; trichloro(nitro)methane CAS Name: 2-chloro-1-nitropropane; trichloro(nitro)methane IUPAC Name: 2-chloro-1-nitropropane; trichloro(nitro)methane Traditional Name: 2-chloro-1-nitro-propane; trichloro(nitro)methane Formula: C4H6Cl4N2O4 MolecularWeight: 287.91344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H6ClNO2.CCl3NO2/c1-3(4)2-5(6)7;2-1(3,4)5(6)7/h3H,2H2,1H3;