disodium 1-(2-methylpropyl)naphthalene sulfate

Systemtic Name: disodium 1-(2-methylpropyl)naphthalene sulfate Openeye Name: disodium 1-isobutylnaphthalene sulfate CAS Name: disodium 1-(2-methylpropyl)naphthalene sulfate IUPAC Name: disodium 1-(2-methylpropyl)naphthalene sulfate Traditional Name: disodium 1-isobutylnaphthalene sulfate Formula: C14H16Na2O4S MolecularWeight: 326.31898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=CC2=CC=CC=C21.[O-]S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC(C)CC1=CC=CC2=CC=CC=C21.[O-]S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C14H16.2Na.H2O4S/c1-11(2)10-13-8-5-7-12-6-3-4-9-14(12)13;;;1-5(2,3)4/h3-9,11H,10H2,1-2H3;;;(H2,1,2,3,4)/q;2*+1;/p-2