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1,3-benzothiazol-2-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium

1,3-benzothiazol-2-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name:1,3-benzothiazol-2-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium
Openeye Name:1,3-benzothiazol-2-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-methyl-ammonium
CAS Name:1,3-benzothiazol-2-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-methylammonium
IUPAC Name:1,3-benzothiazol-2-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-methylazanium
Traditional Name:1,3-benzothiazol-2-ylmethyl-methyl-o-veratryl-ammonium
Formula: C18H21N2O2S+
MolecularWeight: 329.43654
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC2=NC3=CC=CC=C3S2


Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC2=NC3=CC=CC=C3S2


InChI

InChI=1S/C18H20N2O2S/c1-20(11-13-7-6-9-15(21-2)18(13)22-3)12-17-19-14-8-4-5-10-16(14)23-17/h4-10H,11-12H2,1-3H3/p+1


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