2-[3-cyano-1,1,1-tris(fluoranyl)-2-oxidanyl-3-(phenylsulfonyl)propan-2-yl]guanidine

Systemtic Name: 2-[3-cyano-1,1,1-tris(fluoranyl)-2-oxidanyl-3-(phenylsulfonyl)propan-2-yl]guanidine Openeye Name: 2-[1-[benzenesulfonyl(cyano)methyl]-2,2,2-trifluoro-1-hydroxy-ethyl]guanidine CAS Name: 2-[3-(benzenesulfonyl)-3-cyano-1,1,1-trifluoro-2-hydroxypropan-2-yl]guanidine IUPAC Name: 2-[3-(benzenesulfonyl)-3-cyano-1,1,1-trifluoro-2-hydroxypropan-2-yl]guanidine Traditional Name: 2-[1-[besyl(cyano)methyl]-2,2,2-trifluoro-1-hydroxy-ethyl]guanidine Formula: C11H11F3N4O3S MolecularWeight: 336.29025

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(C#N)C(C(F)(F)F)(N=C(N)N)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(C#N)C(C(F)(F)F)(N=C(N)N)O

InChI

InChI=1S/C11H11F3N4O3S/c12-11(13,14)10(19,18-9(16)17)8(6-15)22(20,21)7-4-2-1-3-5-7/h1-5,8,19H,(H4,16,17,18)