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ethoxy-morpholin-4-yl-(2,4,6-trinitrophenyl)sulfanyl-methanethiol

ethoxy-morpholin-4-yl-(2,4,6-trinitrophenyl)sulfanyl-methanethiol

Systemtic Name:ethoxy-morpholin-4-yl-(2,4,6-trinitrophenyl)sulfanyl-methanethiol
Openeye Name:ethoxy-morpholino-(2,4,6-trinitrophenyl)sulfanyl-methanethiol
CAS Name:ethoxy-(4-morpholinyl)-[(2,4,6-trinitrophenyl)thio]methanethiol
IUPAC Name:ethoxy-morpholin-4-yl-(2,4,6-trinitrophenyl)sulfanylmethanethiol
Traditional Name:ethoxy-morpholino-(picrylthio)methanethiol
Formula: C13H16N4O8S2
MolecularWeight: 420.41814
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(N1CCOCC1)(S)SC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CCOC(N1CCOCC1)(S)SC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C13H16N4O8S2/c1-2-25-13(26,14-3-5-24-6-4-14)27-12-10(16(20)21)7-9(15(18)19)8-11(12)17(22)23/h7-8,26H,2-6H2,1H3


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