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

Systemtic Name: (2-ethoxyphenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone Openeye Name: (2-ethoxyphenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]-1-piperidyl]methanone CAS Name: (2-ethoxyphenyl)-[4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinyl]methanone IUPAC Name: (2-ethoxyphenyl)-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone Traditional Name: o-phenetyl-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidino]methanone Formula: C21H21F3N4O2 MolecularWeight: 418.41225

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)N2CCC(CC2)N3C4=C(C=C(C=C4)C(F)(F)F)N=N3

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N2CCC(CC2)N3C4=C(C=C(C=C4)C(F)(F)F)N=N3

InChI

InChI=1S/C21H21F3N4O2/c1-2-30-19-6-4-3-5-16(19)20(29)27-11-9-15(10-12-27)28-18-8-7-14(21(22,23)24)13-17(18)25-26-28/h3-8,13,15H,2,9-12H2,1H3