2,4-bis(azanyl)-6-butan-2-yl-3,5-dinitro-benzenecarbonitrile

Systemtic Name: 2,4-bis(azanyl)-6-butan-2-yl-3,5-dinitro-benzenecarbonitrile Openeye Name: 2,4-diamino-3,5-dinitro-6-sec-butyl-benzonitrile CAS Name: 2,4-diamino-6-butan-2-yl-3,5-dinitrobenzonitrile IUPAC Name: 2,4-diamino-6-butan-2-yl-3,5-dinitrobenzonitrile Traditional Name: 2,4-diamino-3,5-dinitro-6-sec-butyl-benzonitrile Formula: C11H13N5O4 MolecularWeight: 279.25202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C(=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])N)C#N

Isomeric SMILES

CCC(C)C1=C(C(=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])N)C#N

InChI

InChI=1S/C11H13N5O4/c1-3-5(2)7-6(4-12)8(13)11(16(19)20)9(14)10(7)15(17)18/h5H,3,13-14H2,1-2H3