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

Systemtic Name: 2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium Formula: C12H17ClN3OS+ MolecularWeight: 286.80088

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=NC2=C(C=CC(=C2S1)Cl)OC

Isomeric SMILES

C[NH+](C)CCNC1=NC2=C(C=CC(=C2S1)Cl)OC

InChI

InChI=1S/C12H16ClN3OS/c1-16(2)7-6-14-12-15-10-9(17-3)5-4-8(13)11(10)18-12/h4-5H,6-7H2,1-3H3,(H,14,15)/p+1