(E)-3-phenyl-1-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-phenyl-1-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-[4-[5-(trifluoromethyl)benzotriazol-1-yl]-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-phenyl-1-[4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-phenyl-1-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidino]prop-2-en-1-one Formula: C21H19F3N4O MolecularWeight: 400.39697

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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)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C21H19F3N4O/c22-21(23,24)16-7-8-19-18(14-16)25-26-28(19)17-10-12-27(13-11-17)20(29)9-6-15-4-2-1-3-5-15/h1-9,14,17H,10-13H2/b9-6+