4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-(phenylmethyl)isoquinoline

Systemtic Name: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-(phenylmethyl)isoquinoline Openeye Name: 1-benzyl-4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-isoquinoline CAS Name: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-(phenylmethyl)isoquinoline IUPAC Name: 1-benzyl-4-[(4-chlorophenyl)methyl]-6,7-dimethoxyisoquinoline Traditional Name: 1-benzyl-4-(4-chlorobenzyl)-6,7-dimethoxy-isoquinoline Formula: C25H22ClNO2 MolecularWeight: 403.90068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN=C2CC3=CC=CC=C3)CC4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN=C2CC3=CC=CC=C3)CC4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C25H22ClNO2/c1-28-24-14-21-19(12-18-8-10-20(26)11-9-18)16-27-23(22(21)15-25(24)29-2)13-17-6-4-3-5-7-17/h3-11,14-16H,12-13H2,1-2H3