2-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-isoquinolin-2-ium

Systemtic Name: 2-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-isoquinolin-2-ium Openeye Name: 2-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-isoquinolin-2-ium CAS Name: 2-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxyisoquinolin-2-ium IUPAC Name: 2-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxyisoquinolin-2-ium Traditional Name: 2-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-isoquinolin-2-ium Formula: C21H21N2O2+ MolecularWeight: 333.40364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=[N+](C=CC2=C1)CCC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C2C=[N+](C=CC2=C1)CCC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C21H21N2O2/c1-24-20-11-15-7-9-23(14-17(15)12-21(20)25-2)10-8-16-13-22-19-6-4-3-5-18(16)19/h3-7,9,11-14,22H,8,10H2,1-2H3/q+1