5-[[(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[[(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[[(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[[(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[[(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[[(7-chloro-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C23H20ClN3O5 MolecularWeight: 453.875

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)C)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)C)C(=O)O1)C

InChI

InChI=1S/C23H20ClN3O5/c1-23(2)31-21(29)16(22(30)32-23)12-25-19-20(28)27(3)17-10-9-14(24)11-15(17)18(26-19)13-7-5-4-6-8-13/h4-12,19,25H,1-3H3