1-[[2-(2-chloroethyl)-4,5-dimethoxy-phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline

Systemtic Name: 1-[[2-(2-chloroethyl)-4,5-dimethoxy-phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Openeye Name: 1-[[2-(2-chloroethyl)-4,5-dimethoxy-phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline CAS Name: 1-[[2-(2-chloroethyl)-4,5-dimethoxyphenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline IUPAC Name: 1-[[2-(2-chloroethyl)-4,5-dimethoxyphenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Traditional Name: 1-[2-(2-chloroethyl)-4,5-dimethoxy-benzyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Formula: C22H26ClNO4 MolecularWeight: 403.89914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CC3=CC(=C(C=C3CCCl)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CC3=CC(=C(C=C3CCCl)OC)OC)OC

InChI

InChI=1S/C22H26ClNO4/c1-25-19-10-14(5-7-23)16(12-21(19)27-3)9-18-17-13-22(28-4)20(26-2)11-15(17)6-8-24-18/h10-13H,5-9H2,1-4H3