6,7-dimethoxy-2-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]-3,4-dihydro-1H-isoquinoline; ethanedioic acid

Systemtic Name: 6,7-dimethoxy-2-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]-3,4-dihydro-1H-isoquinoline; ethanedioic acid Openeye Name: 6,7-dimethoxy-2-[(5-methoxy-2-methyl-3-phenyl-benzofuran-6-yl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid CAS Name: 6,7-dimethoxy-2-[(5-methoxy-2-methyl-3-phenyl-6-benzofuranyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid IUPAC Name: 6,7-dimethoxy-2-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid Traditional Name: 6,7-dimethoxy-2-[(5-methoxy-2-methyl-3-phenyl-benzofuran-6-yl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid Formula: C30H31NO8 MolecularWeight: 533.56904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2O1)CN3CCC4=CC(=C(C=C4C3)OC)OC)OC)C5=CC=CC=C5.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2O1)CN3CCC4=CC(=C(C=C4C3)OC)OC)OC)C5=CC=CC=C5.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H29NO4.C2H2O4/c1-18-28(19-8-6-5-7-9-19)23-15-24(30-2)22(14-25(23)33-18)17-29-11-10-20-12-26(31-3)27(32-4)13-21(20)16-29;3-1(4)2(5)6/h5-9,12-15H,10-11,16-17H2,1-4H3;(H,3,4)(H,5,6)