(2S)-2-methyl-N-[3-[(Z)-C-methyl-N-oxidanidyl-carbonimidoyl]phenyl]piperidin-1-ium-1-sulfonamide

Systemtic Name: (2S)-2-methyl-N-[3-[(Z)-C-methyl-N-oxidanidyl-carbonimidoyl]phenyl]piperidin-1-ium-1-sulfonamide Openeye Name: (2S)-2-methyl-N-[3-[(Z)-C-methyl-N-oxido-carbonimidoyl]phenyl]piperidin-1-ium-1-sulfonamide CAS Name: (2S)-2-methyl-N-[3-[(1Z)-1-oxidoiminoethyl]phenyl]-1-piperidin-1-iumsulfonamide IUPAC Name: (2S)-2-methyl-N-[3-[(Z)-C-methyl-N-oxidocarbonimidoyl]phenyl]piperidin-1-ium-1-sulfonamide Traditional Name: (2S)-2-methyl-N-[3-[(Z)-C-methyl-N-oxido-carbonimidoyl]phenyl]piperidin-1-ium-1-sulfonamide Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1S(=O)(=O)NC2=CC=CC(=C2)C(=N[O-])C

Isomeric SMILES

C[C@H]1CCCC[NH+]1S(=O)(=O)NC2=CC=CC(=C2)/C(=N\[O-])/C

InChI

InChI=1S/C14H21N3O3S/c1-11-6-3-4-9-17(11)21(19,20)16-14-8-5-7-13(10-14)12(2)15-18/h5,7-8,10-11,16,18H,3-4,6,9H2,1-2H3/b15-12-/t11-/m0/s1