N-butyl-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: N-butyl-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: N-butyl-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1,1-dioxo-thiolan-3-amine CAS Name: N-butyl-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1,1-dioxo-3-thiolanamine IUPAC Name: N-butyl-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1,1-dioxothiolan-3-amine Traditional Name: butyl-(1,1-diketothiolan-3-yl)-[2,6-dinitro-4-(trifluoromethyl)phenyl]amine Formula: C15H18F3N3O6S MolecularWeight: 425.38013

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H18F3N3O6S/c1-2-3-5-19(11-4-6-28(26,27)9-11)14-12(20(22)23)7-10(15(16,17)18)8-13(14)21(24)25/h7-8,11H,2-6,9H2,1H3