1-azanylcyclobutane-1-carboxylate; 4-methylbenzenesulfonate

Systemtic Name: 1-azanylcyclobutane-1-carboxylate; 4-methylbenzenesulfonate Openeye Name: 1-aminocyclobutanecarboxylate; 4-methylbenzenesulfonate CAS Name: 1-amino-1-cyclobutanecarboxylate; 4-methylbenzenesulfonate IUPAC Name: 1-aminocyclobutane-1-carboxylate; 4-methylbenzenesulfonate Traditional Name: 1-aminocyclobutanecarboxylate tosylate Formula: C12H15NO5S-2 MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(C1)(C(=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(C1)(C(=O)[O-])N

InChI

InChI=1S/C7H8O3S.C5H9NO2/c1-6-2-4-7(5-3-6)11(8,9)10;6-5(4(7)8)2-1-3-5/h2-5H,1H3,(H,8,9,10);1-3,6H2,(H,7,8)/p-2