[(1S)-1-(furan-2-yl)-2-[[(1S)-1-phenylbutyl]amino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(furan-2-yl)-2-[[(1S)-1-phenylbutyl]amino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-furyl)-2-[[(1S)-1-phenylbutyl]amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-furanyl)-2-[[(1S)-1-phenylbutyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(furan-2-yl)-2-[[(1S)-1-phenylbutyl]amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-furyl)-2-[[(1S)-1-phenylbutyl]amino]ethyl]-dimethyl-ammonium Formula: C18H27N2O+ MolecularWeight: 287.41978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NCC(C2=CC=CO2)[NH+](C)C

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC[C@@H](C2=CC=CO2)[NH+](C)C

InChI

InChI=1S/C18H26N2O/c1-4-9-16(15-10-6-5-7-11-15)19-14-17(20(2)3)18-12-8-13-21-18/h5-8,10-13,16-17,19H,4,9,14H2,1-3H3/p+1/t16-,17-/m0/s1