3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-benzimidazol-2-one

Systemtic Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-benzimidazol-2-one Openeye Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-benzimidazol-2-one CAS Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-benzimidazol-2-one IUPAC Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-benzimidazol-2-one Traditional Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-benzimidazol-2-one Formula: C17H18N3O+ MolecularWeight: 280.34432

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CN3C4=CC=CC=C4NC3=O

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C17H17N3O/c21-17-18-15-7-3-4-8-16(15)20(17)12-19-10-9-13-5-1-2-6-14(13)11-19/h1-8H,9-12H2,(H,18,21)/p+1