2-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C20H26NO+ MolecularWeight: 296.42654

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

C[C@H](CCC1=CC=C(C=C1)OC)[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H25NO/c1-16(7-8-17-9-11-20(22-2)12-10-17)21-14-13-18-5-3-4-6-19(18)15-21/h3-6,9-12,16H,7-8,13-15H2,1-2H3/p+1/t16-/m1/s1