N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dimethoxy-benzamide

Systemtic Name: N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dimethoxy-benzamide Openeye Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dimethoxy-benzamide CAS Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dimethoxybenzamide IUPAC Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dimethoxybenzamide Traditional Name: N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3,5-dimethoxy-benzamide Formula: C22H18IN3O3 MolecularWeight: 499.30109

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N=C2C3=CC=CC=C3CN4C=C(C=CC4=N2)I)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N=C2C3=CC=CC=C3CN4C=C(C=CC4=N2)I)OC

InChI

InChI=1S/C22H18IN3O3/c1-28-17-9-15(10-18(11-17)29-2)22(27)25-21-19-6-4-3-5-14(19)12-26-13-16(23)7-8-20(26)24-21/h3-11,13H,12H2,1-2H3