[2-[(1S)-1-azaniumylethyl]phenyl]-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide

Systemtic Name: [2-[(1S)-1-azaniumylethyl]phenyl]-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide Openeye Name: [2-[(1S)-1-azaniumylethyl]phenyl]-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide CAS Name: [2-[(1S)-1-ammonioethyl]phenyl]-[(4-methyl-1-piperidin-1-iumyl)sulfonyl]azanide IUPAC Name: [2-[(1S)-1-azaniumylethyl]phenyl]-(4-methylpiperidin-1-ium-1-yl)sulfonylazanide Traditional Name: [2-[(1S)-1-ammonioethyl]phenyl]-(4-methylpiperidin-1-ium-1-yl)sulfonyl-azanide Formula: C14H24N3O2S+ MolecularWeight: 298.42426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)S(=O)(=O)[N-]C2=CC=CC=C2C(C)[NH3+]

Isomeric SMILES

CC1CC[NH+](CC1)S(=O)(=O)[N-]C2=CC=CC=C2[C@H](C)[NH3+]

InChI

InChI=1S/C14H22N3O2S/c1-11-7-9-17(10-8-11)20(18,19)16-14-6-4-3-5-13(14)12(2)15/h3-6,11-12H,7-10,15H2,1-2H3/q-1/p+2/t12-/m0/s1