3-[(dimethylazaniumyl)methyl]-2-ethoxycarbonyl-1-benzofuran-4-olate

Systemtic Name: 3-[(dimethylazaniumyl)methyl]-2-ethoxycarbonyl-1-benzofuran-4-olate Openeye Name: 3-[(dimethylammonio)methyl]-2-ethoxycarbonyl-benzofuran-4-olate CAS Name: 3-[(dimethylammonio)methyl]-2-ethoxycarbonyl-4-benzofuranolate IUPAC Name: 3-[(dimethylazaniumyl)methyl]-2-ethoxycarbonyl-1-benzofuran-4-olate Traditional Name: 2-carbethoxy-3-[(dimethylammonio)methyl]benzofuran-4-olate Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2O1)[O-])C[NH+](C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2O1)[O-])C[NH+](C)C

InChI

InChI=1S/C14H17NO4/c1-4-18-14(17)13-9(8-15(2)3)12-10(16)6-5-7-11(12)19-13/h5-7,16H,4,8H2,1-3H3