2-chloranyl-4-nitro-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]benzamide Openeye Name: 2-chloro-4-nitro-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]benzamide CAS Name: 2-chloro-4-nitro-N-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]benzamide Traditional Name: 2-chloro-4-nitro-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]benzamide Formula: C18H16ClF3N4O3 MolecularWeight: 428.79285

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H16ClF3N4O3/c19-15-9-13(26(28)29)2-3-14(15)17(27)24-12-5-7-25(8-6-12)16-4-1-11(10-23-16)18(20,21)22/h1-4,9-10,12H,5-8H2,(H,24,27)