3-[[(1S)-1-(7-methoxy-1-benzofuran-2-yl)ethyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(1S)-1-(7-methoxy-1-benzofuran-2-yl)ethyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-1-(7-methoxybenzofuran-2-yl)ethyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(1S)-1-(7-methoxy-2-benzofuranyl)ethyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(1S)-1-(7-methoxy-1-benzofuran-2-yl)ethyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(1S)-1-(7-methoxybenzofuran-2-yl)ethyl]ammonio]propyl-dimethyl-ammonium Formula: C16H26N2O2+2 MolecularWeight: 278.38984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C(=CC=C2)OC)[NH2+]CCC[NH+](C)C

Isomeric SMILES

C[C@@H](C1=CC2=C(O1)C(=CC=C2)OC)[NH2+]CCC[NH+](C)C

InChI

InChI=1S/C16H24N2O2/c1-12(17-9-6-10-18(2)3)15-11-13-7-5-8-14(19-4)16(13)20-15/h5,7-8,11-12,17H,6,9-10H2,1-4H3/p+2/t12-/m0/s1