sodium; (2-butylphenyl) sulfate; phenol

Systemtic Name: sodium; (2-butylphenyl) sulfate; phenol Openeye Name: sodium; (2-butylphenyl) sulfate; phenol CAS Name: sodium; (2-butylphenyl) sulfate; phenol IUPAC Name: sodium; (2-butylphenyl) sulfate; phenol Traditional Name: sodium; (2-butylphenyl) sulfate; phenol Formula: C16H19NaO5S MolecularWeight: 346.37383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1OS(=O)(=O)[O-].C1=CC=C(C=C1)O.[Na+]

Isomeric SMILES

CCCCC1=CC=CC=C1OS(=O)(=O)[O-].C1=CC=C(C=C1)O.[Na+]

InChI

InChI=1S/C10H14O4S.C6H6O.Na/c1-2-3-6-9-7-4-5-8-10(9)14-15(11,12)13;7-6-4-2-1-3-5-6;/h4-5,7-8H,2-3,6H2,1H3,(H,11,12,13);1-5,7H;/q;;+1/p-1