2-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)-1H-1,3-diazepine

Systemtic Name: 2-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)-1H-1,3-diazepine Openeye Name: 2-tert-butoxy-5-(trifluoromethyl)-1H-1,3-diazepine CAS Name: 2-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)-1H-1,3-diazepine IUPAC Name: 2-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)-1H-1,3-diazepine Traditional Name: 2-tert-butoxy-5-(trifluoromethyl)-1H-1,3-diazepine Formula: C10H13F3N2O MolecularWeight: 234.21823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=NC=C(C=CN1)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC1=NC=C(C=CN1)C(F)(F)F

InChI

InChI=1S/C10H13F3N2O/c1-9(2,3)16-8-14-5-4-7(6-15-8)10(11,12)13/h4-6H,1-3H3,(H,14,15)