6,7-dimethoxy-2-oxidanidyl-1-phenyl-3,4-dihydroisoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-oxidanidyl-1-phenyl-3,4-dihydroisoquinolin-2-ium Openeye Name: 6,7-dimethoxy-2-oxido-1-phenyl-3,4-dihydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-oxido-1-phenyl-3,4-dihydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-oxido-1-phenyl-3,4-dihydroisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-2-oxido-1-phenyl-3,4-dihydroisoquinolin-2-ium Formula: C17H17NO3 MolecularWeight: 283.32178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC[N+](=C2C3=CC=CC=C3)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC[N+](=C2C3=CC=CC=C3)[O-])OC

InChI

InChI=1S/C17H17NO3/c1-20-15-10-13-8-9-18(19)17(12-6-4-3-5-7-12)14(13)11-16(15)21-2/h3-7,10-11H,8-9H2,1-2H3