1,3-benzothiazol-2-ylmethyl-[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-keto-ethyl]-methyl-ammonium Formula: C19H21ClN3O2S+ MolecularWeight: 390.90694

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O2S/c1-23(13-19-22-16-4-2-3-5-17(16)26-19)12-18(24)21-10-11-25-15-8-6-14(20)7-9-15/h2-9H,10-13H2,1H3,(H,21,24)/p+1