6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]sesamol Formula: C19H20NO3+ MolecularWeight: 310.367

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC=C1C2=CC=CC=C2)CC3=CC4=C(C=C3O)OCO4

Isomeric SMILES

C1C[NH+](CC=C1C2=CC=CC=C2)CC3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C19H19NO3/c21-17-11-19-18(22-13-23-19)10-16(17)12-20-8-6-15(7-9-20)14-4-2-1-3-5-14/h1-6,10-11,21H,7-9,12-13H2/p+1