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(2-cyano-4,6-dinitro-phenyl) azepane-1-carbodithioate

(2-cyano-4,6-dinitro-phenyl) azepane-1-carbodithioate

Systemtic Name:(2-cyano-4,6-dinitro-phenyl) azepane-1-carbodithioate
Openeye Name:(2-cyano-4,6-dinitro-phenyl) azepane-1-carbodithioate
CAS Name:1-azepanecarbodithioic acid (2-cyano-4,6-dinitrophenyl) ester
IUPAC Name:(2-cyano-4,6-dinitrophenyl) azepane-1-carbodithioate
Traditional Name:azepane-1-carbodithioic acid (2-cyano-4,6-dinitro-phenyl) ester
Formula: C14H14N4O4S2
MolecularWeight: 366.41536
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)SC2=C(C=C(C=C2C#N)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1CCCN(CC1)C(=S)SC2=C(C=C(C=C2C#N)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C14H14N4O4S2/c15-9-10-7-11(17(19)20)8-12(18(21)22)13(10)24-14(23)16-5-3-1-2-4-6-16/h7-8H,1-6H2


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