(3,4-dimethoxyphenyl)methyl-(pyridin-4-ylmethyl)-(thiophen-3-ylmethyl)azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-(pyridin-4-ylmethyl)-(thiophen-3-ylmethyl)azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-(4-pyridylmethyl)-(3-thienylmethyl)ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-(pyridin-4-ylmethyl)-(3-thiophenylmethyl)ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-(pyridin-4-ylmethyl)-(thiophen-3-ylmethyl)azanium Traditional Name: 4-pyridylmethyl-(3-thenyl)-veratryl-ammonium Formula: C20H23N2O2S+ MolecularWeight: 355.47382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CSC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CSC=C3)OC

InChI

InChI=1S/C20H22N2O2S/c1-23-19-4-3-17(11-20(19)24-2)13-22(14-18-7-10-25-15-18)12-16-5-8-21-9-6-16/h3-11,15H,12-14H2,1-2H3/p+1