(2,3-dimethoxyphenyl)methyl-[[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]methyl]-methyl-azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-[[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]methyl]-methyl-azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-[[2-(4-ethoxyphenyl)thiazol-4-yl]methyl]-methyl-ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-[[2-(4-ethoxyphenyl)-4-thiazolyl]methyl]-methylammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-[[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]methyl]-methylazanium Traditional Name: methyl-o-veratryl-[(2-p-phenetylthiazol-4-yl)methyl]ammonium Formula: C22H27N2O3S+ MolecularWeight: 399.52638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)C[NH+](C)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)C[NH+](C)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C22H26N2O3S/c1-5-27-19-11-9-16(10-12-19)22-23-18(15-28-22)14-24(2)13-17-7-6-8-20(25-3)21(17)26-4/h6-12,15H,5,13-14H2,1-4H3/p+1