sodium 4-(7-methyldecan-2-yl)benzenesulfonate

Systemtic Name: sodium 4-(7-methyldecan-2-yl)benzenesulfonate Openeye Name: sodium 4-(1,6-dimethylnonyl)benzenesulfonate CAS Name: sodium 4-(7-methyldecan-2-yl)benzenesulfonate IUPAC Name: sodium 4-(7-methyldecan-2-yl)benzenesulfonate Traditional Name: sodium 4-(1,6-dimethylnonyl)besylate Formula: C17H27NaO3S MolecularWeight: 334.44925

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CCCCC(C)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCC(C)CCCCC(C)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H28O3S.Na/c1-4-7-14(2)8-5-6-9-15(3)16-10-12-17(13-11-16)21(18,19)20;/h10-15H,4-9H2,1-3H3,(H,18,19,20);/q;+1/p-1