(E)-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-phenylprop-2-enamide Traditional Name: (E)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-3-phenyl-acrylamide Formula: C22H16IN3O MolecularWeight: 465.28641

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16IN3O/c23-18-11-12-20-24-22(19-9-5-4-8-17(19)14-26(20)15-18)25-21(27)13-10-16-6-2-1-3-7-16/h1-13,15H,14H2/b13-10+,25-22?