[2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-piperidin-1-yl-methanone Openeye Name: [2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-(1-piperidyl)methanone CAS Name: [2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-piperidin-1-ylmethanone Traditional Name: [2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-piperidino-methanone Formula: C19H17F3N2O4 MolecularWeight: 394.34449

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)OC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)OC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H17F3N2O4/c20-19(21,22)13-4-6-14(7-5-13)28-15-8-9-17(24(26)27)16(12-15)18(25)23-10-2-1-3-11-23/h4-9,12H,1-3,10-11H2