[(2S)-1-(3-butylimidazol-1-ium-1-yl)propan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]sulfamic acid

Systemtic Name: [(2S)-1-(3-butylimidazol-1-ium-1-yl)propan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]sulfamic acid Openeye Name: tert-butoxycarbonyl-[(1S)-2-(3-butylimidazol-1-ium-1-yl)-1-methyl-ethyl]sulfamic acid CAS Name: [(2S)-1-(3-butyl-1-imidazol-1-iumyl)propan-2-yl]-[(2-methylpropan-2-yl)oxy-oxomethyl]sulfamic acid IUPAC Name: [(2S)-1-(3-butylimidazol-1-ium-1-yl)propan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]sulfamic acid Traditional Name: tert-butoxycarbonyl-[(1S)-2-(3-butylimidazol-1-ium-1-yl)-1-methyl-ethyl]sulfamic acid Formula: C15H28N3O5S+ MolecularWeight: 362.46492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CC(C)N(C(=O)OC(C)(C)C)S(=O)(=O)O

Isomeric SMILES

CCCCN1C=C[N+](=C1)C[C@H](C)N(C(=O)OC(C)(C)C)S(=O)(=O)O

InChI

InChI=1S/C15H27N3O5S/c1-6-7-8-16-9-10-17(12-16)11-13(2)18(24(20,21)22)14(19)23-15(3,4)5/h9-10,12-13H,6-8,11H2,1-5H3/p+1/t13-/m0/s1