sodium 4-(6-methyldodecan-3-yl)benzenesulfonate

Systemtic Name: sodium 4-(6-methyldodecan-3-yl)benzenesulfonate Openeye Name: sodium 4-(1-ethyl-4-methyl-decyl)benzenesulfonate CAS Name: sodium 4-(6-methyldodecan-3-yl)benzenesulfonate IUPAC Name: sodium 4-(6-methyldodecan-3-yl)benzenesulfonate Traditional Name: sodium 4-(1-ethyl-4-methyl-decyl)besylate Formula: C19H31NaO3S MolecularWeight: 362.50241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CCC(CC)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCC(C)CCC(CC)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C19H32O3S.Na/c1-4-6-7-8-9-16(3)10-11-17(5-2)18-12-14-19(15-13-18)23(20,21)22;/h12-17H,4-11H2,1-3H3,(H,20,21,22);/q;+1/p-1