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

Systemtic Name: N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-ethanamide Openeye Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-acetamide CAS Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenylacetamide IUPAC Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenylacetamide Traditional Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-phenyl-acetamide Formula: C21H16IN3O MolecularWeight: 453.27571

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)CC3=CC=CC=C3)N=C4N1C=C(C=C4)I

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)CC3=CC=CC=C3)N=C4N1C=C(C=C4)I

InChI

InChI=1S/C21H16IN3O/c22-17-10-11-19-23-21(24-20(26)12-15-6-2-1-3-7-15)18-9-5-4-8-16(18)13-25(19)14-17/h1-11,14H,12-13H2