sodium; 1-butylnaphthalene; hydrogen sulfite

Systemtic Name: sodium; 1-butylnaphthalene; hydrogen sulfite Openeye Name: sodium; 1-butylnaphthalene; hydrogen sulfite CAS Name: sodium; 1-butylnaphthalene; hydrogen sulfite IUPAC Name: sodium; 1-butylnaphthalene; hydrogen sulfite Traditional Name: sodium 1-butylnaphthalene bisulfite Formula: C14H17NaO3S MolecularWeight: 288.33775

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC2=CC=CC=C21.OS(=O)[O-].[Na+]

Isomeric SMILES

CCCCC1=CC=CC2=CC=CC=C21.OS(=O)[O-].[Na+]

InChI

InChI=1S/C14H16.Na.H2O3S/c1-2-3-7-12-9-6-10-13-8-4-5-11-14(12)13;;1-4(2)3/h4-6,8-11H,2-3,7H2,1H3;;(H2,1,2,3)/q;+1;/p-1