sodium 2-propan-2-ylnaphthalene-1-sulfonic acid

Systemtic Name: sodium 2-propan-2-ylnaphthalene-1-sulfonic acid Openeye Name: sodium 2-isopropylnaphthalene-1-sulfonic acid CAS Name: sodium 2-propan-2-yl-1-naphthalenesulfonic acid IUPAC Name: sodium 2-propan-2-ylnaphthalene-1-sulfonic acid Traditional Name: sodium 2-isopropylnaphthalene-1-sulfonic acid Formula: C13H14NaO3S+ MolecularWeight: 273.30323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O.[Na+]

Isomeric SMILES

CC(C)C1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C13H14O3S.Na/c1-9(2)11-8-7-10-5-3-4-6-12(10)13(11)17(14,15)16;/h3-9H,1-2H3,(H,14,15,16);/q;+1