(3-ethylphenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide

Systemtic Name: (3-ethylphenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide Openeye Name: (3-ethylphenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide CAS Name: (3-ethylphenyl)-[[(3S)-3-piperidin-1-iumyl]sulfonyl]azanide IUPAC Name: (3-ethylphenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonylazanide Traditional Name: (3-ethylphenyl)-[(3S)-piperidin-1-ium-3-yl]sulfonyl-azanide Formula: C13H20N2O2S MolecularWeight: 268.3751

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)[N-]S(=O)(=O)C2CCC[NH2+]C2

Isomeric SMILES

CCC1=CC(=CC=C1)[N-]S(=O)(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C13H19N2O2S/c1-2-11-5-3-6-12(9-11)15-18(16,17)13-7-4-8-14-10-13/h3,5-6,9,13-14H,2,4,7-8,10H2,1H3/q-1/p+1/t13-/m0/s1