N1,N4-bis[3-(trifluoromethyl)phenyl]-1,4-diazepane-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[3-(trifluoromethyl)phenyl]-1,4-diazepane-1,4-dicarboxamide Openeye Name: N1,N4-bis[3-(trifluoromethyl)phenyl]-1,4-diazepane-1,4-dicarboxamide CAS Name: N1,N4-bis[3-(trifluoromethyl)phenyl]-1,4-diazepane-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[3-(trifluoromethyl)phenyl]-1,4-diazepane-1,4-dicarboxamide Traditional Name: N,N'-bis[3-(trifluoromethyl)phenyl]-1,4-diazepane-1,4-dicarboxamide Formula: C21H20F6N4O2 MolecularWeight: 474.399519

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H20F6N4O2/c22-20(23,24)14-4-1-6-16(12-14)28-18(32)30-8-3-9-31(11-10-30)19(33)29-17-7-2-5-15(13-17)21(25,26)27/h1-2,4-7,12-13H,3,8-11H2,(H,28,32)(H,29,33)