4-[2-[2-(decylamino)ethylamino]ethylamino]-4-oxidanylidene-2-sulfo-butanoic acid

Systemtic Name: 4-[2-[2-(decylamino)ethylamino]ethylamino]-4-oxidanylidene-2-sulfo-butanoic acid Openeye Name: 4-[2-[2-(decylamino)ethylamino]ethylamino]-4-oxo-2-sulfo-butanoic acid CAS Name: 4-[2-[2-(decylamino)ethylamino]ethylamino]-4-oxo-2-sulfobutanoic acid IUPAC Name: 4-[2-[2-(decylamino)ethylamino]ethylamino]-4-oxo-2-sulfobutanoic acid Traditional Name: 4-[2-[2-(decylamino)ethylamino]ethylamino]-4-keto-2-sulfo-butyric acid Formula: C18H37N3O6S MolecularWeight: 423.56788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNCCNCCNC(=O)CC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCNCCNCCNC(=O)CC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H37N3O6S/c1-2-3-4-5-6-7-8-9-10-19-11-12-20-13-14-21-17(22)15-16(18(23)24)28(25,26)27/h16,19-20H,2-15H2,1H3,(H,21,22)(H,23,24)(H,25,26,27)