N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-nitro-benzamide

Systemtic Name: N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-nitro-benzamide Openeye Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-nitro-benzamide CAS Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-nitrobenzamide IUPAC Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-nitrobenzamide Traditional Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-nitro-benzamide Formula: C20H13BrN4O3 MolecularWeight: 437.24622

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=C4N1C=C(C=C4)Br

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=C4N1C=C(C=C4)Br

InChI

InChI=1S/C20H13BrN4O3/c21-15-8-9-18-22-19(17-7-2-1-4-14(17)11-24(18)12-15)23-20(26)13-5-3-6-16(10-13)25(27)28/h1-10,12H,11H2