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

Systemtic Name: [[2-[3-(azaniumylamino)-3-oxidanylidene-propyl]-5-butoxy-4-oxidanyl-pentanoyl]amino]azanium Openeye Name: [[2-[3-(azaniumylamino)-3-oxo-propyl]-5-butoxy-4-hydroxy-pentanoyl]amino]ammonium CAS Name: [[4-[(ammonioamino)-oxomethyl]-7-butoxy-6-hydroxy-1-oxoheptyl]amino]ammonium IUPAC Name: [[2-[3-(azaniumylamino)-3-oxopropyl]-5-butoxy-4-hydroxypentanoyl]amino]azanium Traditional Name: [[2-[3-(ammonioamino)-3-keto-propyl]-5-butoxy-4-hydroxy-pentanoyl]amino]ammonium Formula: C12H28N4O4+2 MolecularWeight: 292.37512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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