3-(6-bromanyl-7,8-dimethoxy-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)benzamide

Systemtic Name: 3-(6-bromanyl-7,8-dimethoxy-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)benzamide Openeye Name: 3-(6-bromo-7,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzamide CAS Name: 3-(6-bromo-7,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzamide IUPAC Name: 3-(6-bromo-7,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzamide Traditional Name: 3-(6-bromo-2-keto-7,8-dimethoxy-1-methyl-3H-1,4-benzodiazepin-5-yl)benzamide Formula: C19H18BrN3O4 MolecularWeight: 432.26792

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C(C(=C(C=C21)OC)OC)Br)C3=CC(=CC=C3)C(=O)N

Isomeric SMILES

CN1C(=O)CN=C(C2=C(C(=C(C=C21)OC)OC)Br)C3=CC(=CC=C3)C(=O)N

InChI

InChI=1S/C19H18BrN3O4/c1-23-12-8-13(26-2)18(27-3)16(20)15(12)17(22-9-14(23)24)10-5-4-6-11(7-10)19(21)25/h4-8H,9H2,1-3H3,(H2,21,25)