6-nitro-3-piperidin-4-yl-1H-indole; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 6-nitro-3-piperidin-4-yl-1H-indole; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 6-nitro-3-(4-piperidyl)-1H-indole; 2,2,2-trifluoroacetic acid CAS Name: 6-nitro-3-(4-piperidinyl)-1H-indole; 2,2,2-trifluoroacetic acid IUPAC Name: 6-nitro-3-piperidin-4-yl-1H-indole; 2,2,2-trifluoroacetic acid Traditional Name: 6-nitro-3-(4-piperidyl)-1H-indole; 2,2,2-trifluoroacetic acid Formula: C15H16F3N3O4 MolecularWeight: 359.30045

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=CNC3=C2C=CC(=C3)[N+](=O)[O-].C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CNCCC1C2=CNC3=C2C=CC(=C3)[N+](=O)[O-].C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H15N3O2.C2HF3O2/c17-16(18)10-1-2-11-12(8-15-13(11)7-10)9-3-5-14-6-4-9;3-2(4,5)1(6)7/h1-2,7-9,14-15H,3-6H2;(H,6,7)