2-azanylethanesulfonic acid; 1-chloranyl-1-ethyl-3-nitroso-urea

Systemtic Name: 2-azanylethanesulfonic acid; 1-chloranyl-1-ethyl-3-nitroso-urea Openeye Name: 2-aminoethanesulfonic acid; 1-chloro-1-ethyl-3-nitroso-urea CAS Name: 2-aminoethanesulfonic acid; 1-chloro-1-ethyl-3-nitrosourea IUPAC Name: 2-aminoethanesulfonic acid; 1-chloro-1-ethyl-3-nitrosourea Traditional Name: 2-aminoethanesulfonic acid; 1-chloro-1-ethyl-3-nitroso-urea Formula: C5H13ClN4O5S MolecularWeight: 276.69852

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)NN=O)Cl.C(CS(=O)(=O)O)N

Isomeric SMILES

CCN(C(=O)NN=O)Cl.C(CS(=O)(=O)O)N

InChI

InChI=1S/C3H6ClN3O2.C2H7NO3S/c1-2-7(4)3(8)5-6-9;3-1-2-7(4,5)6/h2H2,1H3,(H,5,8,9);1-3H2,(H,4,5,6)