3-butyl-1,2,3,4-tetrahydronaphthalene-1,2-disulfonate

Systemtic Name: 3-butyl-1,2,3,4-tetrahydronaphthalene-1,2-disulfonate Openeye Name: 3-butyltetralin-1,2-disulfonate CAS Name: 3-butyl-1,2,3,4-tetrahydronaphthalene-1,2-disulfonate IUPAC Name: 3-butyl-1,2,3,4-tetrahydronaphthalene-1,2-disulfonate Traditional Name: 3-butyltetralin-1,2-disulfonate Formula: C14H18O6S2-2 MolecularWeight: 346.41912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC2=CC=CC=C2C(C1S(=O)(=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

CCCCC1CC2=CC=CC=C2C(C1S(=O)(=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C14H20O6S2/c1-2-3-6-11-9-10-7-4-5-8-12(10)14(22(18,19)20)13(11)21(15,16)17/h4-5,7-8,11,13-14H,2-3,6,9H2,1H3,(H,15,16,17)(H,18,19,20)/p-2