2-methyl-N-pyridin-1-ium-4-yl-[1]benzofuro[3,2-d]pyrimidin-4-amine

Systemtic Name: 2-methyl-N-pyridin-1-ium-4-yl-[1]benzofuro[3,2-d]pyrimidin-4-amine Openeye Name: 2-methyl-N-pyridin-1-ium-4-yl-benzofuro[3,2-d]pyrimidin-4-amine CAS Name: 2-methyl-N-(4-pyridin-1-iumyl)-4-benzofuro[3,2-d]pyrimidinamine IUPAC Name: 2-methyl-N-pyridin-1-ium-4-yl-[1]benzofuro[3,2-d]pyrimidin-4-amine Traditional Name: (2-methylbenzofuro[3,2-d]pyrimidin-4-yl)-pyridin-1-ium-4-yl-amine Formula: C16H13N4O+ MolecularWeight: 277.30062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC3=CC=[NH+]C=C3)OC4=CC=CC=C42

Isomeric SMILES

CC1=NC2=C(C(=N1)NC3=CC=[NH+]C=C3)OC4=CC=CC=C42

InChI

InChI=1S/C16H12N4O/c1-10-18-14-12-4-2-3-5-13(12)21-15(14)16(19-10)20-11-6-8-17-9-7-11/h2-9H,1H3,(H,17,18,19,20)/p+1