1-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)methanamine; ethanedioic acid

Systemtic Name: 1-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)methanamine; ethanedioic acid Openeye Name: 1-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)methanamine; oxalic acid CAS Name: 1-(3,4-dimethoxyphenyl)-N-(2-furanylmethyl)methanamine; oxalic acid IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)methanamine; oxalic acid Traditional Name: 2-furfuryl(veratryl)amine; oxalic acid Formula: C16H19NO7 MolecularWeight: 337.32456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCC2=CC=CO2)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNCC2=CC=CO2)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H17NO3.C2H2O4/c1-16-13-6-5-11(8-14(13)17-2)9-15-10-12-4-3-7-18-12;3-1(4)2(5)6/h3-8,15H,9-10H2,1-2H3;(H,3,4)(H,5,6)