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

Systemtic Name: 4-chloranyl-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)butanamide Openeye Name: 4-chloro-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)butanamide CAS Name: 4-chloro-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)butanamide IUPAC Name: 4-chloro-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)butanamide Traditional Name: 4-chloro-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)butyramide Formula: C17H15ClIN3O MolecularWeight: 439.67797

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)CCCCl)N=C3N1C=C(C=C3)I

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)CCCCl)N=C3N1C=C(C=C3)I

InChI

InChI=1S/C17H15ClIN3O/c18-9-3-6-16(23)21-17-14-5-2-1-4-12(14)10-22-11-13(19)7-8-15(22)20-17/h1-2,4-5,7-8,11H,3,6,9-10H2