(6-bromanyl-3-ethoxycarbonyl-5-oxidanyl-1-benzofuran-2-yl)methyl-dimethyl-azanium

Systemtic Name: (6-bromanyl-3-ethoxycarbonyl-5-oxidanyl-1-benzofuran-2-yl)methyl-dimethyl-azanium Openeye Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-benzofuran-2-yl)methyl-dimethyl-ammonium CAS Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-2-benzofuranyl)methyl-dimethylammonium IUPAC Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-benzofuran-2-yl)methyl-dimethylazanium Traditional Name: (6-bromo-3-carbethoxy-5-hydroxy-benzofuran-2-yl)methyl-dimethyl-ammonium Formula: C14H17BrNO4+ MolecularWeight: 343.19308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)O)Br)C[NH+](C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)O)Br)C[NH+](C)C

InChI

InChI=1S/C14H16BrNO4/c1-4-19-14(18)13-8-5-10(17)9(15)6-11(8)20-12(13)7-16(2)3/h5-6,17H,4,7H2,1-3H3/p+1