2-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[3-(2-isopropyl-5-methyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[3-(2-isopropyl-5-methyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C22H30NO+ MolecularWeight: 324.4797

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO/c1-17(2)21-10-9-18(3)15-22(21)24-14-6-12-23-13-11-19-7-4-5-8-20(19)16-23/h4-5,7-10,15,17H,6,11-14,16H2,1-3H3/p+1