[1-sulfonatosulfanyl-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]benzene

Systemtic Name: [1-sulfonatosulfanyl-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]benzene Openeye Name: [1-sulfonatosulfanyl-2-(1,1,3,3-tetramethylbutylamino)ethyl]benzene CAS Name: [1-(sulfonatothio)-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]benzene IUPAC Name: [1-sulfonatosulfanyl-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]benzene Traditional Name: [1-(sulfonatothio)-2-(1,1,3,3-tetramethylbutylamino)ethyl]benzene Formula: C16H26NO3S2- MolecularWeight: 344.51254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NCC(C1=CC=CC=C1)SS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)CC(C)(C)NCC(C1=CC=CC=C1)SS(=O)(=O)[O-]

InChI

InChI=1S/C16H27NO3S2/c1-15(2,3)12-16(4,5)17-11-14(21-22(18,19)20)13-9-7-6-8-10-13/h6-10,14,17H,11-12H2,1-5H3,(H,18,19,20)/p-1