5-[2,2-bis(fluoranyl)propanoyl]-7-bromanyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2,2-bis(fluoranyl)propanoyl]-7-bromanyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 7-bromo-5-(2,2-difluoropropanoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 7-bromo-5-(2,2-difluoro-1-oxopropyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 7-bromo-5-(2,2-difluoropropanoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 7-bromo-5-(2,2-difluoropropanoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C12H11BrF2N2O2 MolecularWeight: 333.128746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(=O)NC2=C1C=C(C=C2)Br)(F)F

Isomeric SMILES

CC(C(=O)N1CCC(=O)NC2=C1C=C(C=C2)Br)(F)F

InChI

InChI=1S/C12H11BrF2N2O2/c1-12(14,15)11(19)17-5-4-10(18)16-8-3-2-7(13)6-9(8)17/h2-3,6H,4-5H2,1H3,(H,16,18)