1-[5-[2-(cyclohexylamino)pyridin-1-ium-1-yl]carbonylthiophen-2-yl]ethanone

Systemtic Name: 1-[5-[2-(cyclohexylamino)pyridin-1-ium-1-yl]carbonylthiophen-2-yl]ethanone Openeye Name: 1-[5-[2-(cyclohexylamino)pyridin-1-ium-1-carbonyl]-2-thienyl]ethanone CAS Name: 1-[5-[[2-(cyclohexylamino)-1-pyridin-1-iumyl]-oxomethyl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-[2-(cyclohexylamino)pyridin-1-ium-1-carbonyl]thiophen-2-yl]ethanone Traditional Name: 1-[5-[2-(cyclohexylamino)pyridin-1-ium-1-carbonyl]-2-thienyl]ethanone Formula: C18H21N2O2S+ MolecularWeight: 329.43654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)[N+]2=CC=CC=C2NC3CCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)[N+]2=CC=CC=C2NC3CCCCC3

InChI

InChI=1S/C18H20N2O2S/c1-13(21)15-10-11-16(23-15)18(22)20-12-6-5-9-17(20)19-14-7-3-2-4-8-14/h5-6,9-12,14H,2-4,7-8H2,1H3/p+1