N-[3,5-bis(trifluoromethyl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-nitro-4-piperidino-benzamide Formula: C20H17F6N3O3 MolecularWeight: 461.357699

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H17F6N3O3/c21-19(22,23)13-9-14(20(24,25)26)11-15(10-13)27-18(30)12-4-5-16(17(8-12)29(31)32)28-6-2-1-3-7-28/h4-5,8-11H,1-3,6-7H2,(H,27,30)