2-(2-aminocarbonylbutyl)-6-azanyl-5-oxidanylidene-6-(sulfomethyl)octanoic acid

Systemtic Name: 2-(2-aminocarbonylbutyl)-6-azanyl-5-oxidanylidene-6-(sulfomethyl)octanoic acid Openeye Name: 6-amino-2-(2-carbamoylbutyl)-5-oxo-6-(sulfomethyl)octanoic acid CAS Name: 6-amino-2-(2-carbamoylbutyl)-5-oxo-6-(sulfomethyl)octanoic acid IUPAC Name: 6-amino-2-(2-carbamoylbutyl)-5-oxo-6-(sulfomethyl)octanoic acid Traditional Name: 6-amino-2-(2-carbamoylbutyl)-5-keto-6-(sulfomethyl)caprylic acid Formula: C14H26N2O7S MolecularWeight: 366.43044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CCC(=O)C(CC)(CS(=O)(=O)O)N)C(=O)O)C(=O)N

Isomeric SMILES

CCC(CC(CCC(=O)C(CC)(CS(=O)(=O)O)N)C(=O)O)C(=O)N

InChI

InChI=1S/C14H26N2O7S/c1-3-9(12(15)18)7-10(13(19)20)5-6-11(17)14(16,4-2)8-24(21,22)23/h9-10H,3-8,16H2,1-2H3,(H2,15,18)(H,19,20)(H,21,22,23)