9-chloranyl-5-phenyl-1-[2,2,2-tris(fluoranyl)ethyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 9-chloranyl-5-phenyl-1-[2,2,2-tris(fluoranyl)ethyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 9-chloro-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 9-chloro-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 9-chloro-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 9-chloro-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-2-one Formula: C17H12ClF3N2O MolecularWeight: 352.73819

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=CC=C2Cl)C(=N1)C3=CC=CC=C3)CC(F)(F)F

Isomeric SMILES

C1C(=O)N(C2=C(C=CC=C2Cl)C(=N1)C3=CC=CC=C3)CC(F)(F)F

InChI

InChI=1S/C17H12ClF3N2O/c18-13-8-4-7-12-15(11-5-2-1-3-6-11)22-9-14(24)23(16(12)13)10-17(19,20)21/h1-8H,9-10H2