3-[(4-chloranyl-1,3-benzothiazol-2-yl)-(1,2-oxazol-5-ylcarbonyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-chloranyl-1,3-benzothiazol-2-yl)-(1,2-oxazol-5-ylcarbonyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-(isoxazole-5-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-[5-isoxazolyl(oxo)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-(1,2-oxazole-5-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-(isoxazole-5-carbonyl)amino]propyl-dimethyl-ammonium Formula: C16H18ClN4O2S+ MolecularWeight: 365.85772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)C3=CC=NO3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)C3=CC=NO3

InChI

InChI=1S/C16H17ClN4O2S/c1-20(2)9-4-10-21(15(22)12-7-8-18-23-12)16-19-14-11(17)5-3-6-13(14)24-16/h3,5-8H,4,9-10H2,1-2H3/p+1