2-(anthracen-9-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-(anthracen-9-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-(9-anthrylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-(9-anthracenylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-(anthracen-9-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(9-anthrylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C26H26NO2+ MolecularWeight: 384.49014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC3=C4C=CC=CC4=CC5=CC=CC=C53)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CC3=C4C=CC=CC4=CC5=CC=CC=C53)OC

InChI

InChI=1S/C26H25NO2/c1-28-25-14-18-11-12-27(16-21(18)15-26(25)29-2)17-24-22-9-5-3-7-19(22)13-20-8-4-6-10-23(20)24/h3-10,13-15H,11-12,16-17H2,1-2H3/p+1