2-hexyl-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-hexyl-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-hexyl-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-hexyl-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-hexyl-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-hexyl-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH+]1CCC2=C(C1)C=C(C=C2)OC

Isomeric SMILES

CCCCCC[NH+]1CCC2=C(C1)C=C(C=C2)OC

InChI

InChI=1S/C16H25NO/c1-3-4-5-6-10-17-11-9-14-7-8-16(18-2)12-15(14)13-17/h7-8,12H,3-6,9-11,13H2,1-2H3/p+1