sodium [2-(carboxyamino)-5-[(carboxyamino)methyl]-2-hexyl-decyl] sulfate

Systemtic Name: sodium [2-(carboxyamino)-5-[(carboxyamino)methyl]-2-hexyl-decyl] sulfate Openeye Name: sodium [2-(carboxyamino)-5-[(carboxyamino)methyl]-2-hexyl-decyl] sulfate CAS Name: sodium [2-(carboxyamino)-5-[(carboxyamino)methyl]-2-hexyldecyl] sulfate IUPAC Name: sodium [2-(carboxyamino)-5-[(carboxyamino)methyl]-2-hexyldecyl] sulfate Traditional Name: sodium [2-(carboxyamino)-5-[(carboxyamino)methyl]-2-hexyl-decyl] sulfate Formula: C19H37N2NaO8S MolecularWeight: 476.56045

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC(CCCCC)CNC(=O)O)(COS(=O)(=O)[O-])NC(=O)O.[Na+]

Isomeric SMILES

CCCCCCC(CCC(CCCCC)CNC(=O)O)(COS(=O)(=O)[O-])NC(=O)O.[Na+]

InChI

InChI=1S/C19H38N2O8S.Na/c1-3-5-7-9-12-19(21-18(24)25,15-29-30(26,27)28)13-11-16(10-8-6-4-2)14-20-17(22)23;/h16,20-21H,3-15H2,1-2H3,(H,22,23)(H,24,25)(H,26,27,28);/q;+1/p-1