4-[(2-dodecoxy-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-2-sulfonato-butanoate

Systemtic Name: 4-[(2-dodecoxy-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-2-sulfonato-butanoate Openeye Name: 4-[(2-dodecoxy-2-oxo-ethyl)amino]-4-oxo-2-sulfonato-butanoate CAS Name: 4-[(2-dodecoxy-2-oxoethyl)amino]-4-oxo-2-sulfonatobutanoate IUPAC Name: 4-[(2-dodecoxy-2-oxoethyl)amino]-4-oxo-2-sulfonatobutanoate Traditional Name: 4-keto-4-[(2-keto-2-lauryloxy-ethyl)amino]-2-sulfonato-butyrate Formula: C18H31NO8S-2 MolecularWeight: 421.50564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C18H33NO8S/c1-2-3-4-5-6-7-8-9-10-11-12-27-17(21)14-19-16(20)13-15(18(22)23)28(24,25)26/h15H,2-14H2,1H3,(H,19,20)(H,22,23)(H,24,25,26)/p-2