N-naphthalen-2-yl-4-[4,4,4-tris(fluoranyl)butanoyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-naphthalen-2-yl-4-[4,4,4-tris(fluoranyl)butanoyl]-1,4-diazepane-1-carboxamide Openeye Name: N-(2-naphthyl)-4-(4,4,4-trifluorobutanoyl)-1,4-diazepane-1-carboxamide CAS Name: N-(2-naphthalenyl)-4-(4,4,4-trifluoro-1-oxobutyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-naphthalen-2-yl-4-(4,4,4-trifluorobutanoyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2-naphthyl)-4-(4,4,4-trifluorobutanoyl)-1,4-diazepane-1-carboxamide Formula: C20H22F3N3O2 MolecularWeight: 393.40279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)CCC(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)CCC(F)(F)F

InChI

InChI=1S/C20H22F3N3O2/c21-20(22,23)9-8-18(27)25-10-3-11-26(13-12-25)19(28)24-17-7-6-15-4-1-2-5-16(15)14-17/h1-2,4-7,14H,3,8-13H2,(H,24,28)