2-[(2S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-2-yl]ethylazanium

Systemtic Name: 2-[(2S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-2-yl]ethylazanium Openeye Name: 2-[(2S)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-2-piperidyl]ethylammonium CAS Name: 2-[(2S)-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-2-piperidinyl]ethylammonium IUPAC Name: 2-[(2S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-2-yl]ethylazanium Traditional Name: 2-[(2S)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-2-piperidyl]ethylammonium Formula: C12H22N3O3S+ MolecularWeight: 288.38638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCCC2CC[NH3+]

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC[C@H]2CC[NH3+]

InChI

InChI=1S/C12H21N3O3S/c1-9-12(10(2)18-14-9)19(16,17)15-8-4-3-5-11(15)6-7-13/h11H,3-8,13H2,1-2H3/p+1/t11-/m0/s1