6-chloranyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3-benzoxazole

Systemtic Name: 6-chloranyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3-benzoxazole Openeye Name: 6-chloro-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3-benzoxazole CAS Name: 6-chloro-2-[2-(4-morpholin-4-iumyl)ethylthio]-1,3-benzoxazole IUPAC Name: 6-chloro-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3-benzoxazole Traditional Name: 6-chloro-2-(2-morpholin-4-ium-4-ylethylthio)-1,3-benzoxazole Formula: C13H16ClN2O2S+ MolecularWeight: 299.79634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NC3=C(O2)C=C(C=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CCSC2=NC3=C(O2)C=C(C=C3)Cl

InChI

InChI=1S/C13H15ClN2O2S/c14-10-1-2-11-12(9-10)18-13(15-11)19-8-5-16-3-6-17-7-4-16/h1-2,9H,3-8H2/p+1