1-tert-butyl-3-methyl-naphthalene-2-sulfonic acid

Systemtic Name: 1-tert-butyl-3-methyl-naphthalene-2-sulfonic acid Openeye Name: 1-tert-butyl-3-methyl-naphthalene-2-sulfonic acid CAS Name: 1-tert-butyl-3-methyl-2-naphthalenesulfonic acid IUPAC Name: 1-tert-butyl-3-methylnaphthalene-2-sulfonic acid Traditional Name: 1-tert-butyl-3-methyl-naphthalene-2-sulfonic acid Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=C1S(=O)(=O)O)C(C)(C)C

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=C1S(=O)(=O)O)C(C)(C)C

InChI

InChI=1S/C15H18O3S/c1-10-9-11-7-5-6-8-12(11)13(15(2,3)4)14(10)19(16,17)18/h5-9H,1-4H3,(H,16,17,18)