2-[3-[[(2S)-butan-2-yl]-(2,5-dimethylfuran-3-yl)carbonyl-amino]propanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[[(2S)-butan-2-yl]-(2,5-dimethylfuran-3-yl)carbonyl-amino]propanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[3-[(2,5-dimethylfuran-3-carbonyl)-[(1S)-1-methylpropyl]amino]propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-[[(2S)-butan-2-yl]-[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[3-[[(2S)-butan-2-yl]-(2,5-dimethylfuran-3-carbonyl)amino]propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[3-[(2,5-dimethyl-3-furoyl)-[(1S)-1-methylpropyl]amino]propanoylamino]ethyl-dimethyl-ammonium Formula: C18H32N3O3+ MolecularWeight: 338.46498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCC(=O)NCC[NH+](C)C)C(=O)C1=C(OC(=C1)C)C

Isomeric SMILES

CC[C@H](C)N(CCC(=O)NCC[NH+](C)C)C(=O)C1=C(OC(=C1)C)C

InChI

InChI=1S/C18H31N3O3/c1-7-13(2)21(10-8-17(22)19-9-11-20(5)6)18(23)16-12-14(3)24-15(16)4/h12-13H,7-11H2,1-6H3,(H,19,22)/p+1/t13-/m0/s1