2-[3-(2-iodanyl-4-methyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[3-(2-iodanyl-4-methyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[3-(2-iodo-4-methyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[3-(2-iodo-4-methylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[3-(2-iodo-4-methylphenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[3-(2-iodo-4-methyl-phenoxy)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C19H23INO+ MolecularWeight: 408.29649

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22INO/c1-15-7-8-19(18(20)13-15)22-12-4-10-21-11-9-16-5-2-3-6-17(16)14-21/h2-3,5-8,13H,4,9-12,14H2,1H3/p+1