4-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-N'-hydroxy-benzamidine CAS Name: 4-[[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-N'-hydroxybenzenecarboximidamide Traditional Name: 4-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-N'-hydroxy-benzamidine Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC2=CC=C(C=C2)C(=NO)N)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC2=CC=C(C=C2)/C(=N\O)/N)C

InChI

InChI=1S/C15H23N3O/c1-11-4-3-5-12(2)18(11)10-13-6-8-14(9-7-13)15(16)17-19/h6-9,11-12,19H,3-5,10H2,1-2H3,(H2,16,17)/p+1/t11-,12-/m0/s1