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

Systemtic Name: (6-bromanyl-3-ethoxycarbonyl-5-oxidanyl-1-benzofuran-2-yl)methyl-diethyl-azanium Openeye Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-benzofuran-2-yl)methyl-diethyl-ammonium CAS Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-2-benzofuranyl)methyl-diethylammonium IUPAC Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-benzofuran-2-yl)methyl-diethylazanium Traditional Name: (6-bromo-3-carbethoxy-5-hydroxy-benzofuran-2-yl)methyl-diethyl-ammonium Formula: C16H21BrNO4+ MolecularWeight: 371.24624

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C2=CC(=C(C=C2O1)Br)O)C(=O)OCC

Isomeric SMILES

CC[NH+](CC)CC1=C(C2=CC(=C(C=C2O1)Br)O)C(=O)OCC

InChI

InChI=1S/C16H20BrNO4/c1-4-18(5-2)9-14-15(16(20)21-6-3)10-7-12(19)11(17)8-13(10)22-14/h7-8,19H,4-6,9H2,1-3H3/p+1