2-[[2,3-bis(chloranyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline; ethanedioic acid

Systemtic Name: 2-[[2,3-bis(chloranyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline; ethanedioic acid Openeye Name: 2-[(2,3-dichlorophenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline; oxalic acid CAS Name: 2-[(2,3-dichlorophenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline; oxalic acid IUPAC Name: 2-[(2,3-dichlorophenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline; oxalic acid Traditional Name: 2-(2,3-dichlorobenzyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline; oxalic acid Formula: C20H21Cl2NO6 MolecularWeight: 442.28984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=C(C(=CC=C3)Cl)Cl)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=C(C(=CC=C3)Cl)Cl)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H19Cl2NO2.C2H2O4/c1-22-16-8-12-6-7-21(11-14(12)9-17(16)23-2)10-13-4-3-5-15(19)18(13)20;3-1(4)2(5)6/h3-5,8-9H,6-7,10-11H2,1-2H3;(H,3,4)(H,5,6)