2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzoxazole

Systemtic Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzoxazole Openeye Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzoxazole CAS Name: 2-[2-(1-piperidin-1-iumyl)ethylthio]-1,3-benzoxazole IUPAC Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzoxazole Traditional Name: 2-(2-piperidin-1-ium-1-ylethylthio)-1,3-benzoxazole Formula: C14H19N2OS+ MolecularWeight: 263.37846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCSC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1CC[NH+](CC1)CCSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C14H18N2OS/c1-4-8-16(9-5-1)10-11-18-14-15-12-6-2-3-7-13(12)17-14/h2-3,6-7H,1,4-5,8-11H2/p+1