ethanedioic acid; 2-(furan-2-ylmethylsulfanyl)-N-[(4-methoxyphenyl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 2-(furan-2-ylmethylsulfanyl)-N-[(4-methoxyphenyl)methyl]ethanamine Openeye Name: 2-(2-furylmethylsulfanyl)-N-[(4-methoxyphenyl)methyl]ethanamine; oxalic acid CAS Name: 2-(2-furanylmethylthio)-N-[(4-methoxyphenyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(furan-2-ylmethylsulfanyl)-N-[(4-methoxyphenyl)methyl]ethanamine; oxalic acid Traditional Name: 2-(2-furfurylthio)ethyl-p-anisyl-amine; oxalic acid Formula: C17H21NO6S MolecularWeight: 367.41674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNCCSCC2=CC=CO2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CNCCSCC2=CC=CO2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H19NO2S.C2H2O4/c1-17-14-6-4-13(5-7-14)11-16-8-10-19-12-15-3-2-9-18-15;3-1(4)2(5)6/h2-7,9,16H,8,10-12H2,1H3;(H,3,4)(H,5,6)