N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methoxy-2-thiophen-2-yl-ethanamine; ethanedioic acid

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methoxy-2-thiophen-2-yl-ethanamine; ethanedioic acid Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methoxy-2-(2-thienyl)ethanamine; oxalic acid CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methoxy-2-thiophen-2-ylethanamine; oxalic acid IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methoxy-2-thiophen-2-ylethanamine; oxalic acid Traditional Name: homoveratryl-[2-methoxy-2-(2-thienyl)ethyl]amine; oxalic acid Formula: C19H25NO7S MolecularWeight: 411.4693

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(C2=CC=CS2)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(C2=CC=CS2)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H23NO3S.C2H2O4/c1-19-14-7-6-13(11-15(14)20-2)8-9-18-12-16(21-3)17-5-4-10-22-17;3-1(4)2(5)6/h4-7,10-11,16,18H,8-9,12H2,1-3H3;(H,3,4)(H,5,6)