(5R)-N-(5-chloranylpyridin-1-ium-2-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-amine

Systemtic Name: (5R)-N-(5-chloranylpyridin-1-ium-2-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-amine Openeye Name: (5R)-N-(5-chloropyridin-1-ium-2-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-amine CAS Name: (5R)-N-(5-chloro-2-pyridin-1-iumyl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-amine IUPAC Name: (5R)-N-(5-chloropyridin-1-ium-2-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-amine Traditional Name: (5-chloropyridin-1-ium-2-yl)-[(5R)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl]amine Formula: C17H20ClN3O3+2 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=CC3=C(C(=C2C1NC4=[NH+]C=C(C=C4)Cl)OC)OCO3

Isomeric SMILES

C[NH+]1CCC2=CC3=C(C(=C2[C@@H]1NC4=[NH+]C=C(C=C4)Cl)OC)OCO3

InChI

InChI=1S/C17H18ClN3O3/c1-21-6-5-10-7-12-15(24-9-23-12)16(22-2)14(10)17(21)20-13-4-3-11(18)8-19-13/h3-4,7-8,17H,5-6,9H2,1-2H3,(H,19,20)/p+2/t17-/m1/s1