3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propyl-propyl-azanium

Systemtic Name: 3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propyl-propyl-azanium Openeye Name: 3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]propyl-propyl-ammonium CAS Name: 3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]propyl-propylammonium IUPAC Name: 3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propyl-propylazanium Traditional Name: 3-(2,2-dimethylcoumaran-7-yl)oxypropyl-propyl-ammonium Formula: C16H26NO2+ MolecularWeight: 264.38314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CCCOC1=CC=CC2=C1OC(C2)(C)C

Isomeric SMILES

CCC[NH2+]CCCOC1=CC=CC2=C1OC(C2)(C)C

InChI

InChI=1S/C16H25NO2/c1-4-9-17-10-6-11-18-14-8-5-7-13-12-16(2,3)19-15(13)14/h5,7-8,17H,4,6,9-12H2,1-3H3/p+1