7-[[(4-methylpyridin-1-ium-2-yl)amino]-thiophen-2-yl-methyl]quinolin-1-ium-8-ol

Systemtic Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-thiophen-2-yl-methyl]quinolin-1-ium-8-ol Openeye Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-(2-thienyl)methyl]quinolin-1-ium-8-ol CAS Name: 7-[[(4-methyl-2-pyridin-1-iumyl)amino]-thiophen-2-ylmethyl]-8-quinolin-1-iumol IUPAC Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-thiophen-2-ylmethyl]quinolin-1-ium-8-ol Traditional Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-(2-thienyl)methyl]quinolin-1-ium-8-ol Formula: C20H19N3OS+2 MolecularWeight: 349.44936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=C(C3=C(C=CC=[NH+]3)C=C2)O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=[NH+]C=C1)NC(C2=C(C3=C(C=CC=[NH+]3)C=C2)O)C4=CC=CS4

InChI

InChI=1S/C20H17N3OS/c1-13-8-10-21-17(12-13)23-19(16-5-3-11-25-16)15-7-6-14-4-2-9-22-18(14)20(15)24/h2-12,19,24H,1H3,(H,21,23)/p+2