(4-nitrophenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone

Systemtic Name: (4-nitrophenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone Openeye Name: (4-nitrophenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]-1-piperidyl]methanone CAS Name: (4-nitrophenyl)-[4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinyl]methanone IUPAC Name: (4-nitrophenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone Traditional Name: (4-nitrophenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidino]methanone Formula: C19H16F3N5O3 MolecularWeight: 419.35725

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16F3N5O3/c20-19(21,22)13-3-6-17-16(11-13)23-24-26(17)14-7-9-25(10-8-14)18(28)12-1-4-15(5-2-12)27(29)30/h1-6,11,14H,7-10H2