N-(2-azanylethyl)-2-methoxy-4-[3-(trifluoromethyl)-1,2-diazirin-3-yl]benzamide

Systemtic Name: N-(2-azanylethyl)-2-methoxy-4-[3-(trifluoromethyl)-1,2-diazirin-3-yl]benzamide Openeye Name: N-(2-aminoethyl)-2-methoxy-4-[3-(trifluoromethyl)diazirin-3-yl]benzamide CAS Name: N-(2-aminoethyl)-2-methoxy-4-[3-(trifluoromethyl)-3-diazirinyl]benzamide IUPAC Name: N-(2-aminoethyl)-2-methoxy-4-[3-(trifluoromethyl)diazirin-3-yl]benzamide Traditional Name: N-(2-aminoethyl)-2-methoxy-4-[3-(trifluoromethyl)diazirin-3-yl]benzamide Formula: C12H13F3N4O2 MolecularWeight: 302.25243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2(N=N2)C(F)(F)F)C(=O)NCCN

Isomeric SMILES

COC1=C(C=CC(=C1)C2(N=N2)C(F)(F)F)C(=O)NCCN

InChI

InChI=1S/C12H13F3N4O2/c1-21-9-6-7(11(18-19-11)12(13,14)15)2-3-8(9)10(20)17-5-4-16/h2-3,6H,4-5,16H2,1H3,(H,17,20)