2-propan-2-ylbenzenesulfonic acid; 2,2,6-trimethylmorpholine

Systemtic Name: 2-propan-2-ylbenzenesulfonic acid; 2,2,6-trimethylmorpholine Openeye Name: 2-isopropylbenzenesulfonic acid; 2,2,6-trimethylmorpholine CAS Name: 2-propan-2-ylbenzenesulfonic acid; 2,2,6-trimethylmorpholine IUPAC Name: 2-propan-2-ylbenzenesulfonic acid; 2,2,6-trimethylmorpholine Traditional Name: 2-isopropylbesylic acid; 2,2,6-trimethylmorpholine Formula: C16H27NO4S MolecularWeight: 329.45488

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCC(O1)(C)C.CC(C)C1=CC=CC=C1S(=O)(=O)O

Isomeric SMILES

CC1CNCC(O1)(C)C.CC(C)C1=CC=CC=C1S(=O)(=O)O

InChI

InChI=1S/C9H12O3S.C7H15NO/c1-7(2)8-5-3-4-6-9(8)13(10,11)12;1-6-4-8-5-7(2,3)9-6/h3-7H,1-2H3,(H,10,11,12);6,8H,4-5H2,1-3H3