N-(2-azanyl-2-oxidanylidene-ethyl)-2-[2,6-bis(azanyl)hexanoylamino]pentanediamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-2-[2,6-bis(azanyl)hexanoylamino]pentanediamide Openeye Name: N-(2-amino-2-oxo-ethyl)-2-(2,6-diaminohexanoylamino)pentanediamide CAS Name: N-(2-amino-2-oxoethyl)-2-[(2,6-diamino-1-oxohexyl)amino]pentanediamide IUPAC Name: N-(2-amino-2-oxoethyl)-2-(2,6-diaminohexanoylamino)pentanediamide Traditional Name: N-(2-amino-2-keto-ethyl)-2-(2,6-diaminohexanoylamino)glutaramide Formula: C13H26N6O4 MolecularWeight: 330.38334

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)NC(CCC(=O)N)C(=O)NCC(=O)N)N

Isomeric SMILES

C(CCN)CC(C(=O)NC(CCC(=O)N)C(=O)NCC(=O)N)N

InChI

InChI=1S/C13H26N6O4/c14-6-2-1-3-8(15)12(22)19-9(4-5-10(16)20)13(23)18-7-11(17)21/h8-9H,1-7,14-15H2,(H2,16,20)(H2,17,21)(H,18,23)(H,19,22)