dimethyl-[1-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]cyclohexyl]azanium Openeye Name: dimethyl-[1-[[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]methyl]cyclohexyl]ammonium CAS Name: dimethyl-[1-[[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]methyl]cyclohexyl]ammonium IUPAC Name: dimethyl-[1-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]cyclohexyl]azanium Traditional Name: dimethyl-[1-[[3-(4-piperidinosulfonylphenyl)propanoylamino]methyl]cyclohexyl]ammonium Formula: C23H38N3O3S+ MolecularWeight: 436.63112

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H37N3O3S/c1-25(2)23(15-5-3-6-16-23)19-24-22(27)14-11-20-9-12-21(13-10-20)30(28,29)26-17-7-4-8-18-26/h9-10,12-13H,3-8,11,14-19H2,1-2H3,(H,24,27)/p+1