3-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-ethanoyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-ethanoyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[acetyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[acetyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[acetyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]propyl-dimethylazanium Traditional Name: 3-[acetyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium Formula: C15H21ClN3O2S+ MolecularWeight: 342.86414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCC[NH+](C)C)C1=NC2=C(C=CC(=C2S1)Cl)OC

Isomeric SMILES

CC(=O)N(CCC[NH+](C)C)C1=NC2=C(C=CC(=C2S1)Cl)OC

InChI

InChI=1S/C15H20ClN3O2S/c1-10(20)19(9-5-8-18(2)3)15-17-13-12(21-4)7-6-11(16)14(13)22-15/h6-7H,5,8-9H2,1-4H3/p+1