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

Systemtic Name: 6,7-dimethoxy-2-[(5-methylfuran-2-yl)methyl]-3,4-dihydro-1H-isoquinoline; ethanedioic acid Openeye Name: 6,7-dimethoxy-2-[(5-methyl-2-furyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid CAS Name: 6,7-dimethoxy-2-[(5-methyl-2-furanyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid IUPAC Name: 6,7-dimethoxy-2-[(5-methylfuran-2-yl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid Traditional Name: 6,7-dimethoxy-2-[(5-methyl-2-furyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid Formula: C19H23NO7 MolecularWeight: 377.38842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2CCC3=CC(=C(C=C3C2)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(O1)CN2CCC3=CC(=C(C=C3C2)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21NO3.C2H2O4/c1-12-4-5-15(21-12)11-18-7-6-13-8-16(19-2)17(20-3)9-14(13)10-18;3-1(4)2(5)6/h4-5,8-9H,6-7,10-11H2,1-3H3;(H,3,4)(H,5,6)