dimethyl-[1-[[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]methyl]cyclohexyl]azanium Openeye Name: dimethyl-[1-[[[4-oxo-4-(2-thienyl)butanoyl]amino]methyl]cyclohexyl]ammonium CAS Name: [1-[[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]methyl]cyclohexyl]-dimethylammonium IUPAC Name: dimethyl-[1-[[(4-oxo-4-thiophen-2-ylbutanoyl)amino]methyl]cyclohexyl]azanium Traditional Name: [1-[[[4-keto-4-(2-thienyl)butanoyl]amino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C17H27N2O2S+ MolecularWeight: 323.47348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C17H26N2O2S/c1-19(2)17(10-4-3-5-11-17)13-18-16(21)9-8-14(20)15-7-6-12-22-15/h6-7,12H,3-5,8-11,13H2,1-2H3,(H,18,21)/p+1