[(2S)-5-methylhexan-2-yl]-[2-(2-methylpropanoylamino)ethyl]azanium

Systemtic Name: [(2S)-5-methylhexan-2-yl]-[2-(2-methylpropanoylamino)ethyl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[2-(2-methylpropanoylamino)ethyl]ammonium CAS Name: [(2S)-5-methylhexan-2-yl]-[2-[(2-methyl-1-oxopropyl)amino]ethyl]ammonium IUPAC Name: [(2S)-5-methylhexan-2-yl]-[2-(2-methylpropanoylamino)ethyl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-[2-(isobutyrylamino)ethyl]ammonium Formula: C13H29N2O+ MolecularWeight: 229.38216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CCNC(=O)C(C)C

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CCNC(=O)C(C)C

InChI

InChI=1S/C13H28N2O/c1-10(2)6-7-12(5)14-8-9-15-13(16)11(3)4/h10-12,14H,6-9H2,1-5H3,(H,15,16)/p+1/t12-/m0/s1