2-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinazoline

Systemtic Name: 2-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinazoline Openeye Name: 2-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinazoline CAS Name: 2-phenyl-4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]quinazoline IUPAC Name: 2-phenyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinazoline Traditional Name: 2-phenyl-4-(4-pyridin-1-ium-2-ylpiperazino)quinazoline Formula: C23H22N5+ MolecularWeight: 368.45428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C23H21N5/c1-2-8-18(9-3-1)22-25-20-11-5-4-10-19(20)23(26-22)28-16-14-27(15-17-28)21-12-6-7-13-24-21/h1-13H,14-17H2/p+1