2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-6-methoxy-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-6-methoxy-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-6-methoxy-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-6-methoxypyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-6-methoxypyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-6-methoxy-pyridin-1-ium-3,5-dicarbonitrile Formula: C15H12BrN4O2+ MolecularWeight: 360.18538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=[NH+]C(=C2C#N)OC)N)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=[NH+]C(=C2C#N)OC)N)C#N)Br

InChI

InChI=1S/C15H11BrN4O2/c1-21-12-4-3-8(5-11(12)16)13-9(6-17)14(19)20-15(22-2)10(13)7-18/h3-5H,1-2H3,(H2,19,20)/p+1