2-methoxy-6-[[[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]amino]methyl]phenol

Systemtic Name: 2-methoxy-6-[[[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]amino]methyl]phenol Openeye Name: 2-methoxy-6-[[[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]amino]methyl]phenol CAS Name: 2-methoxy-6-[[[1-[2-(4-morpholin-4-iumyl)ethyl]-2-benzimidazolyl]amino]methyl]phenol IUPAC Name: 2-methoxy-6-[[[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]amino]methyl]phenol Traditional Name: 2-methoxy-6-[[[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]amino]methyl]phenol Formula: C21H27N4O3+ MolecularWeight: 383.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)CNC2=NC3=CC=CC=C3N2CC[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1O)CNC2=NC3=CC=CC=C3N2CC[NH+]4CCOCC4

InChI

InChI=1S/C21H26N4O3/c1-27-19-8-4-5-16(20(19)26)15-22-21-23-17-6-2-3-7-18(17)25(21)10-9-24-11-13-28-14-12-24/h2-8,26H,9-15H2,1H3,(H,22,23)/p+1