6,7-dimethoxy-4,4-dimethyl-2-oxidanidyl-3H-isoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-4,4-dimethyl-2-oxidanidyl-3H-isoquinolin-2-ium Openeye Name: 6,7-dimethoxy-4,4-dimethyl-2-oxido-3H-isoquinolin-2-ium CAS Name: 6,7-dimethoxy-4,4-dimethyl-2-oxido-3H-isoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-4,4-dimethyl-2-oxido-3H-isoquinolin-2-ium Traditional Name: 6,7-dimethoxy-4,4-dimethyl-2-oxido-3H-isoquinolin-2-ium Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C[N+](=CC2=CC(=C(C=C21)OC)OC)[O-])C

Isomeric SMILES

CC1(C[N+](=CC2=CC(=C(C=C21)OC)OC)[O-])C

InChI

InChI=1S/C13H17NO3/c1-13(2)8-14(15)7-9-5-11(16-3)12(17-4)6-10(9)13/h5-7H,8H2,1-4H3