2-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazino]-N-propyl-acetamide Formula: C16H20F3N5O5 MolecularWeight: 419.35571

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H20F3N5O5/c1-2-3-20-14(25)10-21-4-6-22(7-5-21)15-12(23(26)27)8-11(16(17,18)19)9-13(15)24(28)29/h8-9H,2-7,10H2,1H3,(H,20,25)