1-(3-chloranylpropyl)-6,7-dimethoxy-3-methyl-2-(4-methylphenyl)isoquinolin-2-ium

Systemtic Name: 1-(3-chloranylpropyl)-6,7-dimethoxy-3-methyl-2-(4-methylphenyl)isoquinolin-2-ium Openeye Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-(p-tolyl)isoquinolin-2-ium CAS Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-(4-methylphenyl)isoquinolin-2-ium IUPAC Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-(4-methylphenyl)isoquinolin-2-ium Traditional Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-(p-tolyl)isoquinolin-2-ium Formula: C22H25ClNO2+ MolecularWeight: 370.8924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[N+]2=C(C3=CC(=C(C=C3C=C2C)OC)OC)CCCCl

Isomeric SMILES

CC1=CC=C(C=C1)[N+]2=C(C3=CC(=C(C=C3C=C2C)OC)OC)CCCCl

InChI

InChI=1S/C22H25ClNO2/c1-15-7-9-18(10-8-15)24-16(2)12-17-13-21(25-3)22(26-4)14-19(17)20(24)6-5-11-23/h7-10,12-14H,5-6,11H2,1-4H3/q+1