5-ethylsulfonyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole

Systemtic Name: 5-ethylsulfonyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole Openeye Name: 5-ethylsulfonyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole CAS Name: 5-ethylsulfonyl-2-(4-piperidin-1-iumyl)-1,3-benzoxazole IUPAC Name: 5-ethylsulfonyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole Traditional Name: 5-esyl-2-piperidin-1-ium-4-yl-1,3-benzoxazole Formula: C14H19N2O3S+ MolecularWeight: 295.37726

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CC[NH2+]CC3

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CC[NH2+]CC3

InChI

InChI=1S/C14H18N2O3S/c1-2-20(17,18)11-3-4-13-12(9-11)16-14(19-13)10-5-7-15-8-6-10/h3-4,9-10,15H,2,5-8H2,1H3/p+1