2,4,8-tris(azanyl)-3-oxidanylidene-2-pyrrolidin-2-ylcarbonyl-octanoic acid

Systemtic Name: 2,4,8-tris(azanyl)-3-oxidanylidene-2-pyrrolidin-2-ylcarbonyl-octanoic acid Openeye Name: 2,4,8-triamino-3-oxo-2-(pyrrolidine-2-carbonyl)octanoic acid CAS Name: 2,4,8-triamino-3-oxo-2-[oxo(2-pyrrolidinyl)methyl]octanoic acid IUPAC Name: 2,4,8-triamino-3-oxo-2-(pyrrolidine-2-carbonyl)octanoic acid Traditional Name: 2,4,8-triamino-3-keto-2-prolyl-caprylic acid Formula: C13H24N4O4 MolecularWeight: 300.35406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)C(C(=O)C(CCCCN)N)(C(=O)O)N

Isomeric SMILES

C1CC(NC1)C(=O)C(C(=O)C(CCCCN)N)(C(=O)O)N

InChI

InChI=1S/C13H24N4O4/c14-6-2-1-4-8(15)10(18)13(16,12(20)21)11(19)9-5-3-7-17-9/h8-9,17H,1-7,14-16H2,(H,20,21)