heptan-4-yl-[2-(2-methylpropanoylamino)ethyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H28N2O/c1-5-7-12(8-6-2)14-9-10-15-13(16)11(3)4/h11-12,14H,5-10H2,1-4H3,(H,15,16)/p+1