3-chloranyl-1,1,3-trinitro-butane

Systemtic Name: 3-chloranyl-1,1,3-trinitro-butane Openeye Name: 3-chloro-1,1,3-trinitro-butane CAS Name: 3-chloro-1,1,3-trinitrobutane IUPAC Name: 3-chloro-1,1,3-trinitrobutane Traditional Name: 3-chloro-1,1,3-trinitro-butane Formula: C4H6ClN3O6 MolecularWeight: 227.55994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6ClN3O6/c1-4(5,8(13)14)2-3(6(9)10)7(11)12/h3H,2H2,1H3