4-oxidanylidene-4-(3-pentadecoxypropylamino)-3-sulfo-butanoic acid

Systemtic Name: 4-oxidanylidene-4-(3-pentadecoxypropylamino)-3-sulfo-butanoic acid Openeye Name: 4-oxo-4-(3-pentadecoxypropylamino)-3-sulfo-butanoic acid CAS Name: 4-oxo-4-(3-pentadecoxypropylamino)-3-sulfobutanoic acid IUPAC Name: 4-oxo-4-(3-pentadecoxypropylamino)-3-sulfobutanoic acid Traditional Name: 4-keto-4-(3-pentadecoxypropylamino)-3-sulfo-butyric acid Formula: C22H43NO7S MolecularWeight: 465.64432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOCCCNC(=O)C(CC(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCOCCCNC(=O)C(CC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C22H43NO7S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-30-18-15-16-23-22(26)20(19-21(24)25)31(27,28)29/h20H,2-19H2,1H3,(H,23,26)(H,24,25)(H,27,28,29)