N-(4-methylsulfonylphenyl)-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-(4-methylsulfonylphenyl)-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-(4-methylsulfonylphenyl)-1-propyl-piperidin-1-ium-4-amine CAS Name: N-(4-methylsulfonylphenyl)-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-(4-methylsulfonylphenyl)-1-propylpiperidin-1-ium-4-amine Traditional Name: (4-mesylphenyl)-(1-propylpiperidin-1-ium-4-yl)amine Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C15H24N2O2S/c1-3-10-17-11-8-14(9-12-17)16-13-4-6-15(7-5-13)20(2,18)19/h4-7,14,16H,3,8-12H2,1-2H3/p+1