3-azanyl-1-ethanoyl-5-[2,2,2-tris(fluoranyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 3-azanyl-1-ethanoyl-5-[2,2,2-tris(fluoranyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-acetyl-3-amino-5-(2,2,2-trifluoroethyl)-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-acetyl-3-amino-5-(2,2,2-trifluoroethyl)-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-acetyl-3-amino-5-(2,2,2-trifluoroethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-acetyl-3-amino-5-(2,2,2-trifluoroethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C13H14F3N3O2 MolecularWeight: 301.26437

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(F)(F)F)N

Isomeric SMILES

CC(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(F)(F)F)N

InChI

InChI=1S/C13H14F3N3O2/c1-8(20)18-6-9(17)12(21)19(7-13(14,15)16)11-5-3-2-4-10(11)18/h2-5,9H,6-7,17H2,1H3