2-methyl-6-(2-phenoxyethoxy)isoquinolin-2-ium

Systemtic Name: 2-methyl-6-(2-phenoxyethoxy)isoquinolin-2-ium Openeye Name: 2-methyl-6-(2-phenoxyethoxy)isoquinolin-2-ium CAS Name: 2-methyl-6-(2-phenoxyethoxy)isoquinolin-2-ium IUPAC Name: 2-methyl-6-(2-phenoxyethoxy)isoquinolin-2-ium Traditional Name: 2-methyl-6-(2-phenoxyethoxy)isoquinolin-2-ium Formula: C18H18NO2+ MolecularWeight: 280.34102

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=C(C=C1)C=C(C=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

C[N+]1=CC2=C(C=C1)C=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C18H18NO2/c1-19-10-9-15-13-18(8-7-16(15)14-19)21-12-11-20-17-5-3-2-4-6-17/h2-10,13-14H,11-12H2,1H3/q+1