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

Systemtic Name: 1-(3-chloranylpropyl)-6,7-dimethoxy-3-methyl-2-phenyl-isoquinolin-2-ium Openeye Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-phenyl-isoquinolin-2-ium CAS Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-phenylisoquinolin-2-ium IUPAC Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-phenylisoquinolin-2-ium Traditional Name: 1-(3-chloropropyl)-6,7-dimethoxy-3-methyl-2-phenyl-isoquinolin-2-ium Formula: C21H23ClNO2+ MolecularWeight: 356.86582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2C(=[N+]1C3=CC=CC=C3)CCCCl)OC)OC

Isomeric SMILES

CC1=CC2=CC(=C(C=C2C(=[N+]1C3=CC=CC=C3)CCCCl)OC)OC

InChI

InChI=1S/C21H23ClNO2/c1-15-12-16-13-20(24-2)21(25-3)14-18(16)19(10-7-11-22)23(15)17-8-5-4-6-9-17/h4-6,8-9,12-14H,7,10-11H2,1-3H3/q+1