[[2-[3-(azaniumylamino)-3-oxidanylidene-propyl]-5-butoxy-4-oxidanyl-pentanoyl]amino]azanium; ethanedioate

Systemtic Name: [[2-[3-(azaniumylamino)-3-oxidanylidene-propyl]-5-butoxy-4-oxidanyl-pentanoyl]amino]azanium; ethanedioate Openeye Name: [[2-[3-(azaniumylamino)-3-oxo-propyl]-5-butoxy-4-hydroxy-pentanoyl]amino]ammonium; oxalate CAS Name: [[4-[(ammonioamino)-oxomethyl]-7-butoxy-6-hydroxy-1-oxoheptyl]amino]ammonium; oxalate IUPAC Name: [[2-[3-(azaniumylamino)-3-oxopropyl]-5-butoxy-4-hydroxypentanoyl]amino]azanium; oxalate Traditional Name: [[2-[3-(ammonioamino)-3-keto-propyl]-5-butoxy-4-hydroxy-pentanoyl]amino]ammonium; oxalate Formula: C14H28N4O8 MolecularWeight: 380.39412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(CC(CCC(=O)N[NH3+])C(=O)N[NH3+])O.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CCCCOCC(CC(CCC(=O)N[NH3+])C(=O)N[NH3+])O.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C12H26N4O4.C2H2O4/c1-2-3-6-20-8-10(17)7-9(12(19)16-14)4-5-11(18)15-13;3-1(4)2(5)6/h9-10,17H,2-8,13-14H2,1H3,(H,15,18)(H,16,19);(H,3,4)(H,5,6)