[3-[[(2S,3S)-2-azaniumyl-3-methyl-pentanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[(2S,3S)-2-azaniumyl-3-methyl-pentanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[(2S,3S)-2-azaniumyl-3-methyl-pentanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[(2S,3S)-2-ammonio-3-methyl-1-oxopentyl]amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[(2S,3S)-2-azaniumyl-3-methylpentanoyl]amino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[(2S,3S)-2-ammonio-3-methyl-pentanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C13H31N3O+2 MolecularWeight: 245.40474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(C)(C)C[NH+](C)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C13H29N3O/c1-7-10(2)11(14)12(17)15-8-13(3,4)9-16(5)6/h10-11H,7-9,14H2,1-6H3,(H,15,17)/p+2/t10-,11-/m0/s1