2-(3,4-dimethoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]ethanamine; ethanedioic acid

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]ethanamine; ethanedioic acid Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[(5-methyl-2-furyl)methyl]ethanamine; oxalic acid CAS Name: 2-(3,4-dimethoxyphenyl)-N-[(5-methyl-2-furanyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]ethanamine; oxalic acid Traditional Name: homoveratryl-[(5-methyl-2-furyl)methyl]amine; oxalic acid Formula: C18H23NO7 MolecularWeight: 365.37772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNCCC2=CC(=C(C=C2)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(O1)CNCCC2=CC(=C(C=C2)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H21NO3.C2H2O4/c1-12-4-6-14(20-12)11-17-9-8-13-5-7-15(18-2)16(10-13)19-3;3-1(4)2(5)6/h4-7,10,17H,8-9,11H2,1-3H3;(H,3,4)(H,5,6)