(5-ethylthiophen-2-yl)-[(3S)-piperidin-1-ium-3-yl]methanone

Systemtic Name: (5-ethylthiophen-2-yl)-[(3S)-piperidin-1-ium-3-yl]methanone Openeye Name: (5-ethyl-2-thienyl)-[(3S)-piperidin-1-ium-3-yl]methanone CAS Name: (5-ethyl-2-thiophenyl)-[(3S)-3-piperidin-1-iumyl]methanone IUPAC Name: (5-ethylthiophen-2-yl)-[(3S)-piperidin-1-ium-3-yl]methanone Traditional Name: (5-ethyl-2-thienyl)-[(3S)-piperidin-1-ium-3-yl]methanone Formula: C12H18NOS+ MolecularWeight: 224.34242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)C2CCC[NH2+]C2

Isomeric SMILES

CCC1=CC=C(S1)C(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C12H17NOS/c1-2-10-5-6-11(15-10)12(14)9-4-3-7-13-8-9/h5-6,9,13H,2-4,7-8H2,1H3/p+1/t9-/m0/s1