N-(3-nitrophenyl)-2-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]ethanamide Openeye Name: N-(3-nitrophenyl)-2-[4-[5-(trifluoromethyl)benzotriazol-1-yl]-1-piperidyl]acetamide CAS Name: N-(3-nitrophenyl)-2-[4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinyl]acetamide IUPAC Name: N-(3-nitrophenyl)-2-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]acetamide Traditional Name: N-(3-nitrophenyl)-2-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidino]acetamide Formula: C20H19F3N6O3 MolecularWeight: 448.39847

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2)CC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2)CC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19F3N6O3/c21-20(22,23)13-4-5-18-17(10-13)25-26-28(18)15-6-8-27(9-7-15)12-19(30)24-14-2-1-3-16(11-14)29(31)32/h1-5,10-11,15H,6-9,12H2,(H,24,30)