1-methylsulfonyl-2-[4-(phenylcarbonyl)morpholin-4-ium-4-yl]guanidine

Systemtic Name: 1-methylsulfonyl-2-[4-(phenylcarbonyl)morpholin-4-ium-4-yl]guanidine Openeye Name: 2-(4-benzoylmorpholin-4-ium-4-yl)-1-methylsulfonyl-guanidine CAS Name: 2-(4-benzoyl-4-morpholin-4-iumyl)-1-methylsulfonylguanidine IUPAC Name: 2-(4-benzoylmorpholin-4-ium-4-yl)-1-methylsulfonylguanidine Traditional Name: 2-(4-benzoylmorpholin-4-ium-4-yl)-1-mesyl-guanidine Formula: C13H19N4O4S+ MolecularWeight: 327.37936

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=N[N+]1(CCOCC1)C(=O)C2=CC=CC=C2)N

Isomeric SMILES

CS(=O)(=O)N/C(=N/[N+]1(CCOCC1)C(=O)C2=CC=CC=C2)/N

InChI

InChI=1S/C13H19N4O4S/c1-22(19,20)16-13(14)15-17(7-9-21-10-8-17)12(18)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H3,14,15,16)/q+1