(2-cyclohexyl-4-oxidanylidene-azetidin-1-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-cyclohexyl-4-oxidanylidene-azetidin-1-yl) 4-methylbenzenesulfonate Openeye Name: (2-cyclohexyl-4-oxo-azetidin-1-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-cyclohexyl-4-oxo-1-azetidinyl) ester IUPAC Name: (2-cyclohexyl-4-oxoazetidin-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-cyclohexyl-4-keto-azetidin-1-yl) ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON2C(CC2=O)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON2C(CC2=O)C3CCCCC3

InChI

InChI=1S/C16H21NO4S/c1-12-7-9-14(10-8-12)22(19,20)21-17-15(11-16(17)18)13-5-3-2-4-6-13/h7-10,13,15H,2-6,11H2,1H3