8-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-10-methylidene-9-thia-7-azaspiro[4.5]decane

Systemtic Name: 8-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-10-methylidene-9-thia-7-azaspiro[4.5]decane Openeye Name: 8-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-10-methylene-9-thia-7-azaspiro[4.5]decane CAS Name: 8-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-10-methylene-9-thia-7-azaspiro[4.5]decane IUPAC Name: 8-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-10-methylidene-9-thia-7-azaspiro[4.5]decane Traditional Name: 8-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-10-methylene-9-thia-7-azaspiro[4.5]decane Formula: C16H16F3N3O4S2 MolecularWeight: 435.44115

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2(CCCC2)CNC(S1)SC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C=C1C2(CCCC2)CNC(S1)SC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H16F3N3O4S2/c1-9-15(4-2-3-5-15)8-20-14(27-9)28-13-11(21(23)24)6-10(16(17,18)19)7-12(13)22(25)26/h6-7,14,20H,1-5,8H2