4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide

Systemtic Name: 4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide Openeye Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-N-cyclopropyl-3-nitrobenzamide IUPAC Name: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-N-cyclopropyl-3-nitrobenzamide Traditional Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazino]-N-cyclopropyl-3-nitro-benzamide Formula: C20H19ClF3N5O3 MolecularWeight: 469.84477

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClF3N5O3/c21-15-10-13(20(22,23)24)11-25-18(15)28-7-5-27(6-8-28)16-4-1-12(9-17(16)29(31)32)19(30)26-14-2-3-14/h1,4,9-11,14H,2-3,5-8H2,(H,26,30)