2-[[4-(1H-indol-3-yl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-(1H-indol-3-yl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-1,3-benzoxazole Openeye Name: 2-[[4-(1H-indol-3-yl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-1,3-benzoxazole CAS Name: 2-[[4-(1H-indol-3-yl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-(1H-indol-3-yl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-1,3-benzoxazole Traditional Name: 2-[[4-(1H-indol-3-yl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-1,3-benzoxazole Formula: C21H20N3O+ MolecularWeight: 330.403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC=C1C2=CNC3=CC=CC=C32)CC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[NH+](CC=C1C2=CNC3=CC=CC=C32)CC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C21H19N3O/c1-2-6-18-16(5-1)17(13-22-18)15-9-11-24(12-10-15)14-21-23-19-7-3-4-8-20(19)25-21/h1-9,13,22H,10-12,14H2/p+1