4-(chloromethyl)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-6,7-dimethoxy-isoquinoline

Systemtic Name: 4-(chloromethyl)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-6,7-dimethoxy-isoquinoline Openeye Name: 4-(chloromethyl)-1-[(2-fluoro-5-methoxy-phenyl)methyl]-6,7-dimethoxy-isoquinoline CAS Name: 4-(chloromethyl)-1-[(2-fluoro-5-methoxyphenyl)methyl]-6,7-dimethoxyisoquinoline IUPAC Name: 4-(chloromethyl)-1-[(2-fluoro-5-methoxyphenyl)methyl]-6,7-dimethoxyisoquinoline Traditional Name: 4-(chloromethyl)-1-(2-fluoro-5-methoxy-benzyl)-6,7-dimethoxy-isoquinoline Formula: C20H19ClFNO3 MolecularWeight: 375.821163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)CC2=NC=C(C3=CC(=C(C=C32)OC)OC)CCl

Isomeric SMILES

COC1=CC(=C(C=C1)F)CC2=NC=C(C3=CC(=C(C=C32)OC)OC)CCl

InChI

InChI=1S/C20H19ClFNO3/c1-24-14-4-5-17(22)12(6-14)7-18-16-9-20(26-3)19(25-2)8-15(16)13(10-21)11-23-18/h4-6,8-9,11H,7,10H2,1-3H3