[4-[(4-acetyloxy-2,2-dinitro-butyl)amino]-3,3-dinitro-butyl] ethanoate

Systemtic Name: [4-[(4-acetyloxy-2,2-dinitro-butyl)amino]-3,3-dinitro-butyl] ethanoate Openeye Name: [4-[(4-acetoxy-2,2-dinitro-butyl)amino]-3,3-dinitro-butyl] acetate CAS Name: acetic acid [4-[(4-acetyloxy-2,2-dinitrobutyl)amino]-3,3-dinitrobutyl] ester IUPAC Name: [4-[(4-acetyloxy-2,2-dinitrobutyl)amino]-3,3-dinitrobutyl] acetate Traditional Name: acetic acid [4-[(4-acetoxy-2,2-dinitro-butyl)amino]-3,3-dinitro-butyl] ester Formula: C12H19N5O12 MolecularWeight: 425.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC(CNCC(CCOC(=O)C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCC(CNCC(CCOC(=O)C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H19N5O12/c1-9(18)28-5-3-11(14(20)21,15(22)23)7-13-8-12(16(24)25,17(26)27)4-6-29-10(2)19/h13H,3-8H2,1-2H3