2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carboxamide Openeye Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carboxamide CAS Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyridine-3-carboxamide Traditional Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]nicotinamide Formula: C17H16F3N5O3 MolecularWeight: 395.33585

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=C(C=CC=N3)C(=O)N

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=C(C=CC=N3)C(=O)N

InChI

InChI=1S/C17H16F3N5O3/c18-17(19,20)11-3-4-13(14(10-11)25(27)28)23-6-8-24(9-7-23)16-12(15(21)26)2-1-5-22-16/h1-5,10H,6-9H2,(H2,21,26)