N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-naphthalen-2-yloxy-ethanamide

Systemtic Name: N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-naphthalen-2-yloxy-ethanamide Openeye Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-(2-naphthyloxy)acetamide CAS Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-(2-naphthalenyloxy)acetamide IUPAC Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-naphthalen-2-yloxyacetamide Traditional Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-(2-naphthoxy)acetamide Formula: C25H18BrN3O2 MolecularWeight: 472.33332

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)COC3=CC4=CC=CC=C4C=C3)N=C5N1C=C(C=C5)Br

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)COC3=CC4=CC=CC=C4C=C3)N=C5N1C=C(C=C5)Br

InChI

InChI=1S/C25H18BrN3O2/c26-20-10-12-23-27-25(22-8-4-3-7-19(22)14-29(23)15-20)28-24(30)16-31-21-11-9-17-5-1-2-6-18(17)13-21/h1-13,15H,14,16H2