(4S)-5-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: (4S)-5-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4S)-5-[2-(4-bromo-2-fluoro-phenoxy)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4S)-5-[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-5-[2-(4-bromo-2-fluorophenoxy)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4S)-5-[2-(4-bromo-2-fluoro-phenoxy)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C18H16BrFN2O3 MolecularWeight: 407.233643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H16BrFN2O3/c1-11-8-17(23)21-14-4-2-3-5-15(14)22(11)18(24)10-25-16-7-6-12(19)9-13(16)20/h2-7,9,11H,8,10H2,1H3,(H,21,23)/t11-/m0/s1