(2-methyl-4-oxidanyl-pentan-2-yl) 2-methanoylnaphthalene-1-sulfonate

Systemtic Name: (2-methyl-4-oxidanyl-pentan-2-yl) 2-methanoylnaphthalene-1-sulfonate Openeye Name: (3-hydroxy-1,1-dimethyl-butyl) 2-formylnaphthalene-1-sulfonate CAS Name: 2-formyl-1-naphthalenesulfonic acid (4-hydroxy-2-methylpentan-2-yl) ester IUPAC Name: (4-hydroxy-2-methylpentan-2-yl) 2-formylnaphthalene-1-sulfonate Traditional Name: 2-formylnaphthalene-1-sulfonic acid (3-hydroxy-1,1-dimethyl-butyl) ester Formula: C17H20O5S MolecularWeight: 336.4027

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)OS(=O)(=O)C1=C(C=CC2=CC=CC=C21)C=O)O

Isomeric SMILES

CC(CC(C)(C)OS(=O)(=O)C1=C(C=CC2=CC=CC=C21)C=O)O

InChI

InChI=1S/C17H20O5S/c1-12(19)10-17(2,3)22-23(20,21)16-14(11-18)9-8-13-6-4-5-7-15(13)16/h4-9,11-12,19H,10H2,1-3H3