N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-yl-cyclohexan-1-amine; ethanedioic acid

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-yl-cyclohexan-1-amine; ethanedioic acid Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(2-thienyl)cyclohexanamine; oxalic acid CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-yl-1-cyclohexanamine; oxalic acid IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-ylcyclohexan-1-amine; oxalic acid Traditional Name: homoveratryl-methyl-[1-(2-thienyl)cyclohexyl]amine; oxalic acid Formula: C23H31NO6S MolecularWeight: 449.56034

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2(CCCCC2)C3=CC=CS3.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2(CCCCC2)C3=CC=CS3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29NO2S.C2H2O4/c1-22(14-11-17-9-10-18(23-2)19(16-17)24-3)21(12-5-4-6-13-21)20-8-7-15-25-20;3-1(4)2(5)6/h7-10,15-16H,4-6,11-14H2,1-3H3;(H,3,4)(H,5,6)