(1R)-1-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: (1R)-1-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: (1R)-1-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-1,2,3,4-tetrahydroisoquinoline CAS Name: (1R)-1-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: (1R)-1-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: (1R)-1-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-1,2,3,4-tetrahydroisoquinoline Formula: C14H21N2+ MolecularWeight: 217.32994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1C2C3=CC=CC=C3CCN2

Isomeric SMILES

C[NH+]1CCC[C@H]1[C@H]2C3=CC=CC=C3CCN2

InChI

InChI=1S/C14H20N2/c1-16-10-4-7-13(16)14-12-6-3-2-5-11(12)8-9-15-14/h2-3,5-6,13-15H,4,7-10H2,1H3/p+1/t13-,14+/m0/s1