sodium N-(13-cyclopentyltridecyl)-N-(4-ethoxyphenyl)sulfamate

Systemtic Name: sodium N-(13-cyclopentyltridecyl)-N-(4-ethoxyphenyl)sulfamate Openeye Name: sodium N-(13-cyclopentyltridecyl)-N-(4-ethoxyphenyl)sulfamate CAS Name: sodium N-(13-cyclopentyltridecyl)-N-(4-ethoxyphenyl)sulfamate IUPAC Name: sodium N-(13-cyclopentyltridecyl)-N-(4-ethoxyphenyl)sulfamate Traditional Name: sodium N-(13-cyclopentyltridecyl)-N-p-phenetyl-sulfamate Formula: C26H44NNaO4S MolecularWeight: 489.68663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CCCCCCCCCCCCCC2CCCC2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CCCCCCCCCCCCCC2CCCC2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C26H45NO4S.Na/c1-2-31-26-21-19-25(20-22-26)27(32(28,29)30)23-15-11-9-7-5-3-4-6-8-10-12-16-24-17-13-14-18-24;/h19-22,24H,2-18,23H2,1H3,(H,28,29,30);/q;+1/p-1