[(4S)-4-[[(2R)-2-azaniumyl-3-methyl-butanoyl]amino]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[[(2R)-2-azaniumyl-3-methyl-butanoyl]amino]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[[(2R)-2-azaniumyl-3-methyl-butanoyl]amino]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[[(2R)-2-ammonio-3-methyl-1-oxobutyl]amino]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[[(2R)-2-azaniumyl-3-methylbutanoyl]amino]pentyl]-diethylazanium Traditional Name: [(4S)-4-[[(2R)-2-ammonio-3-methyl-butanoyl]amino]pentyl]-diethyl-ammonium Formula: C14H33N3O+2 MolecularWeight: 259.43132

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)C(C(C)C)[NH3+]

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)[C@@H](C(C)C)[NH3+]

InChI

InChI=1S/C14H31N3O/c1-6-17(7-2)10-8-9-12(5)16-14(18)13(15)11(3)4/h11-13H,6-10,15H2,1-5H3,(H,16,18)/p+2/t12-,13+/m0/s1