4-methylbenzenesulfonic acid; 2,2,6,6-tetramethylpiperidin-4-one

Systemtic Name: 4-methylbenzenesulfonic acid; 2,2,6,6-tetramethylpiperidin-4-one Openeye Name: 4-methylbenzenesulfonic acid; 2,2,6,6-tetramethylpiperidin-4-one CAS Name: 4-methylbenzenesulfonic acid; 2,2,6,6-tetramethyl-4-piperidinone IUPAC Name: 4-methylbenzenesulfonic acid; 2,2,6,6-tetramethylpiperidin-4-one Traditional Name: 2,2,6,6-tetramethyl-4-piperidone; tosylic acid Formula: C16H25NO4S MolecularWeight: 327.439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1(CC(=O)CC(N1)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1(CC(=O)CC(N1)(C)C)C

InChI

InChI=1S/C9H17NO.C7H8O3S/c1-8(2)5-7(11)6-9(3,4)10-8;1-6-2-4-7(5-3-6)11(8,9)10/h10H,5-6H2,1-4H3;2-5H,1H3,(H,8,9,10)