2-[3-(2,5-dimethylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[3-(2,5-dimethylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[3-(2,5-dimethylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[3-(2,5-dimethylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[3-(2,5-dimethylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[3-(2,5-dimethylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C20H26NO+ MolecularWeight: 296.42654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC[NH+]2CCC3=CC=CC=C3C2

InChI

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