3-[[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(2S)-1-(2-furanylmethylamino)-1-oxopropan-2-yl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[(1S)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl]amino]propyl-dimethyl-ammonium Formula: C13H24N3O2+ MolecularWeight: 254.34856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)NCCC[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CO1)NCCC[NH+](C)C

InChI

InChI=1S/C13H23N3O2/c1-11(14-7-5-8-16(2)3)13(17)15-10-12-6-4-9-18-12/h4,6,9,11,14H,5,7-8,10H2,1-3H3,(H,15,17)/p+1/t11-/m0/s1