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

Systemtic Name: 2-bromanyl-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide Openeye Name: 2-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide CAS Name: 2-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide IUPAC Name: 2-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide Traditional Name: 2-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)benzamide Formula: C20H13BrIN3O MolecularWeight: 518.14519

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C3=CC=CC=C3Br)N=C4N1C=C(C=C4)I

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C3=CC=CC=C3Br)N=C4N1C=C(C=C4)I

InChI

InChI=1S/C20H13BrIN3O/c21-17-8-4-3-7-16(17)20(26)24-19-15-6-2-1-5-13(15)11-25-12-14(22)9-10-18(25)23-19/h1-10,12H,11H2