[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-m-anisyl-methyl-ammonium Formula: C18H21N2OS+ MolecularWeight: 313.43714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)[NH+](C)CC3=CC(=CC=C3)OC

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)[NH+](C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C18H20N2OS/c1-13(18-19-16-9-4-5-10-17(16)22-18)20(2)12-14-7-6-8-15(11-14)21-3/h4-11,13H,12H2,1-3H3/p+1/t13-/m1/s1