6,7-dimethoxy-2-[(E)-2-methyl-3-phenyl-prop-2-enyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-[(E)-2-methyl-3-phenyl-prop-2-enyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 6,7-dimethoxy-2-[(E)-2-methyl-3-phenyl-allyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-[(E)-2-methyl-3-phenylprop-2-enyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-[(E)-2-methyl-3-phenylprop-2-enyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-2-[(E)-2-methyl-3-phenyl-allyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C21H26NO2+ MolecularWeight: 324.43664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C[NH+]2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C[NH+]2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C21H25NO2/c1-16(11-17-7-5-4-6-8-17)14-22-10-9-18-12-20(23-2)21(24-3)13-19(18)15-22/h4-8,11-13H,9-10,14-15H2,1-3H3/p+1/b16-11+