2-(3,4-dimethoxyphenyl)ethyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-(thiophen-3-ylmethyl)azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-(3-thienylmethyl)ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-(3-thiophenylmethyl)ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-(thiophen-3-ylmethyl)azanium Traditional Name: homoveratryl(3-thenyl)ammonium Formula: C15H20NO2S+ MolecularWeight: 278.3898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC2=CSC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC2=CSC=C2)OC

InChI

InChI=1S/C15H19NO2S/c1-17-14-4-3-12(9-15(14)18-2)5-7-16-10-13-6-8-19-11-13/h3-4,6,8-9,11,16H,5,7,10H2,1-2H3/p+1