sodium (2,3-dibutylnaphthalen-1-yl) sulfate

Systemtic Name: sodium (2,3-dibutylnaphthalen-1-yl) sulfate Openeye Name: sodium (2,3-dibutyl-1-naphthyl) sulfate CAS Name: sodium (2,3-dibutyl-1-naphthalenyl) sulfate IUPAC Name: sodium (2,3-dibutylnaphthalen-1-yl) sulfate Traditional Name: sodium (2,3-dibutyl-1-naphthyl) sulfate Formula: C18H23NaO4S MolecularWeight: 358.42759

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=C1CCCC)OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=C1CCCC)OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C18H24O4S.Na/c1-3-5-9-14-13-15-10-7-8-12-17(15)18(22-23(19,20)21)16(14)11-6-4-2;/h7-8,10,12-13H,3-6,9,11H2,1-2H3,(H,19,20,21);/q;+1/p-1