7-bromanyl-5-(2-chloranyl-3,4,5,6-tetradeuterio-phenyl)-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-5-(2-chloranyl-3,4,5,6-tetradeuterio-phenyl)-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-5-(2-chloro-3,4,5,6-tetradeuterio-phenyl)-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-bromo-5-(2-chloro-3,4,5,6-tetradeuteriophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-5-(2-chloro-3,4,5,6-tetradeuteriophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-5-(2-chloro-3,4,5,6-tetradeuterio-phenyl)-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C15H10BrClN2O MolecularWeight: 353.634347

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3Cl

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])C2=NCC(=O)NC3=C2C=C(C=C3)Br)Cl)[2H])[2H]

InChI

InChI=1S/C15H10BrClN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)/i1D,2D,3D,4D