(1S)-6,7-dimethoxy-2,2-dimethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium

Systemtic Name: (1S)-6,7-dimethoxy-2,2-dimethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium Openeye Name: (1S)-6,7-dimethoxy-2,2-dimethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium CAS Name: (1S)-6,7-dimethoxy-2,2-dimethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium IUPAC Name: (1S)-6,7-dimethoxy-2,2-dimethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium Traditional Name: (1S)-6,7-dimethoxy-2,2-dimethyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium Formula: C22H30NO5+ MolecularWeight: 388.4773

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC(=C(C=C2C1C3=CC(=C(C(=C3)OC)OC)OC)OC)OC)C

Isomeric SMILES

C[N+]1(CCC2=CC(=C(C=C2[C@@H]1C3=CC(=C(C(=C3)OC)OC)OC)OC)OC)C

InChI

InChI=1S/C22H30NO5/c1-23(2)9-8-14-10-17(24-3)18(25-4)13-16(14)21(23)15-11-19(26-5)22(28-7)20(12-15)27-6/h10-13,21H,8-9H2,1-7H3/q+1/t21-/m0/s1