2-methyl-N-(oxolan-2-ylmethyl)-1-(3,4,5-trimethoxyphenyl)-3H-benzimidazol-1-ium-5-carboxamide

Systemtic Name: 2-methyl-N-(oxolan-2-ylmethyl)-1-(3,4,5-trimethoxyphenyl)-3H-benzimidazol-1-ium-5-carboxamide Openeye Name: 2-methyl-N-(tetrahydrofuran-2-ylmethyl)-1-(3,4,5-trimethoxyphenyl)-3H-benzimidazol-1-ium-5-carboxamide CAS Name: 2-methyl-N-(2-oxolanylmethyl)-1-(3,4,5-trimethoxyphenyl)-3H-benzimidazol-1-ium-5-carboxamide IUPAC Name: 2-methyl-N-(oxolan-2-ylmethyl)-1-(3,4,5-trimethoxyphenyl)-3H-benzimidazol-1-ium-5-carboxamide Traditional Name: 2-methyl-N-(tetrahydrofurfuryl)-1-(3,4,5-trimethoxyphenyl)-3H-benzimidazol-1-ium-5-carboxamide Formula: C23H28N3O5+ MolecularWeight: 426.48552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(N1)C=C(C=C2)C(=O)NCC3CCCO3)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=[N+](C2=C(N1)C=C(C=C2)C(=O)NCC3CCCO3)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C23H27N3O5/c1-14-25-18-10-15(23(27)24-13-17-6-5-9-31-17)7-8-19(18)26(14)16-11-20(28-2)22(30-4)21(12-16)29-3/h7-8,10-12,17H,5-6,9,13H2,1-4H3,(H,24,27)/p+1