3-azanyl-4-azido-azetidin-2-one; 4-methylbenzenesulfonic acid

Systemtic Name: 3-azanyl-4-azido-azetidin-2-one; 4-methylbenzenesulfonic acid Openeye Name: 3-amino-4-azido-azetidin-2-one; 4-methylbenzenesulfonic acid CAS Name: 3-amino-4-azido-2-azetidinone; 4-methylbenzenesulfonic acid IUPAC Name: 3-amino-4-azidoazetidin-2-one; 4-methylbenzenesulfonic acid Traditional Name: 3-amino-4-azido-azetidin-2-one; tosylic acid Formula: C10H13N5O4S MolecularWeight: 299.30632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1(C(NC1=O)N=[N+]=[N-])N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1(C(NC1=O)N=[N+]=[N-])N

InChI

InChI=1S/C7H8O3S.C3H5N5O/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-2(7-8-5)6-3(1)9/h2-5H,1H3,(H,8,9,10);1-2H,4H2,(H,6,9)