1-[4-[[(3S)-3-(3-methylthiophen-2-yl)carbonylpiperidin-1-ium-1-yl]methyl]thiophen-2-yl]ethanone

Systemtic Name: 1-[4-[[(3S)-3-(3-methylthiophen-2-yl)carbonylpiperidin-1-ium-1-yl]methyl]thiophen-2-yl]ethanone Openeye Name: 1-[4-[[(3S)-3-(3-methylthiophene-2-carbonyl)piperidin-1-ium-1-yl]methyl]-2-thienyl]ethanone CAS Name: 1-[4-[[(3S)-3-[(3-methyl-2-thiophenyl)-oxomethyl]-1-piperidin-1-iumyl]methyl]-2-thiophenyl]ethanone IUPAC Name: 1-[4-[[(3S)-3-(3-methylthiophene-2-carbonyl)piperidin-1-ium-1-yl]methyl]thiophen-2-yl]ethanone Traditional Name: 1-[4-[[(3S)-3-(3-methylthiophene-2-carbonyl)piperidin-1-ium-1-yl]methyl]-2-thienyl]ethanone Formula: C18H22NO2S2+ MolecularWeight: 348.50278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCC[NH+](C2)CC3=CSC(=C3)C(=O)C

Isomeric SMILES

CC1=C(SC=C1)C(=O)[C@H]2CCC[NH+](C2)CC3=CSC(=C3)C(=O)C

InChI

InChI=1S/C18H21NO2S2/c1-12-5-7-22-18(12)17(21)15-4-3-6-19(10-15)9-14-8-16(13(2)20)23-11-14/h5,7-8,11,15H,3-4,6,9-10H2,1-2H3/p+1/t15-/m0/s1