N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-methoxy-benzamide

Systemtic Name: N-(2-bromanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-methoxy-benzamide Openeye Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-methoxy-benzamide CAS Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-methoxybenzamide IUPAC Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-methoxybenzamide Traditional Name: N-(2-bromo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-4-methoxy-benzamide Formula: C21H16BrN3O2 MolecularWeight: 422.27464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16BrN3O2/c1-27-17-9-6-14(7-10-17)21(26)24-20-18-5-3-2-4-15(18)12-25-13-16(22)8-11-19(25)23-20/h2-11,13H,12H2,1H3