2-[dodecyl-(4-oxidanyl-4-oxidanylidene-3-sulfo-butanoyl)amino]butanedioic acid

Systemtic Name: 2-[dodecyl-(4-oxidanyl-4-oxidanylidene-3-sulfo-butanoyl)amino]butanedioic acid Openeye Name: 2-[dodecyl-(4-hydroxy-4-oxo-3-sulfo-butanoyl)amino]butanedioic acid CAS Name: 2-[dodecyl-(4-hydroxy-1,4-dioxo-3-sulfobutyl)amino]butanedioic acid IUPAC Name: 2-[dodecyl-(4-hydroxy-4-oxo-3-sulfobutanoyl)amino]butanedioic acid Traditional Name: 2-[(4-hydroxy-4-keto-3-sulfo-butanoyl)-lauryl-amino]succinic acid Formula: C20H35NO10S MolecularWeight: 481.5576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C(CC(=O)O)C(=O)O)C(=O)CC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCN(C(CC(=O)O)C(=O)O)C(=O)CC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H35NO10S/c1-2-3-4-5-6-7-8-9-10-11-12-21(15(19(25)26)13-18(23)24)17(22)14-16(20(27)28)32(29,30)31/h15-16H,2-14H2,1H3,(H,23,24)(H,25,26)(H,27,28)(H,29,30,31)