(2R)-2-(benzimidazol-1-yl)-N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]propanamide

Systemtic Name: (2R)-2-(benzimidazol-1-yl)-N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]propanamide Openeye Name: (2R)-2-(benzimidazol-1-yl)-N-[(2-morpholinopyridin-1-ium-4-yl)methyl]propanamide CAS Name: (2R)-2-(1-benzimidazolyl)-N-[[2-(4-morpholinyl)-4-pyridin-1-iumyl]methyl]propanamide IUPAC Name: (2R)-2-(benzimidazol-1-yl)-N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]propanamide Traditional Name: (2R)-2-(benzimidazol-1-yl)-N-[(2-morpholinopyridin-1-ium-4-yl)methyl]propionamide Formula: C20H24N5O2+ MolecularWeight: 366.43686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=[NH+]C=C1)N2CCOCC2)N3C=NC4=CC=CC=C43

Isomeric SMILES

C[C@H](C(=O)NCC1=CC(=[NH+]C=C1)N2CCOCC2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C20H23N5O2/c1-15(25-14-23-17-4-2-3-5-18(17)25)20(26)22-13-16-6-7-21-19(12-16)24-8-10-27-11-9-24/h2-7,12,14-15H,8-11,13H2,1H3,(H,22,26)/p+1/t15-/m1/s1