2-(dodecylamino)-3-sulfo-butanedioic acid

Systemtic Name: 2-(dodecylamino)-3-sulfo-butanedioic acid Openeye Name: 2-(dodecylamino)-3-sulfo-butanedioic acid CAS Name: 2-(dodecylamino)-3-sulfobutanedioic acid IUPAC Name: 2-(dodecylamino)-3-sulfobutanedioic acid Traditional Name: 2-(laurylamino)-3-sulfo-succinic acid Formula: C16H31NO7S MolecularWeight: 381.48484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(C(C(=O)O)S(=O)(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCNC(C(C(=O)O)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C16H31NO7S/c1-2-3-4-5-6-7-8-9-10-11-12-17-13(15(18)19)14(16(20)21)25(22,23)24/h13-14,17H,2-12H2,1H3,(H,18,19)(H,20,21)(H,22,23,24)