sodium 2-[7-(4-chlorophenyl)carbonyl-1-benzofuran-5-yl]ethanoate

Systemtic Name: sodium 2-[7-(4-chlorophenyl)carbonyl-1-benzofuran-5-yl]ethanoate Openeye Name: sodium 2-[7-(4-chlorobenzoyl)benzofuran-5-yl]acetate CAS Name: sodium 2-[7-[(4-chlorophenyl)-oxomethyl]-5-benzofuranyl]acetate IUPAC Name: sodium 2-[7-(4-chlorobenzoyl)-1-benzofuran-5-yl]acetate Traditional Name: sodium 2-[7-(4-chlorobenzoyl)benzofuran-5-yl]acetate Formula: C17H10ClNaO4 MolecularWeight: 336.70167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=C3C(=CC(=C2)CC(=O)[O-])C=CO3)Cl.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=C3C(=CC(=C2)CC(=O)[O-])C=CO3)Cl.[Na+]

InChI

InChI=1S/C17H11ClO4.Na/c18-13-3-1-11(2-4-13)16(21)14-8-10(9-15(19)20)7-12-5-6-22-17(12)14;/h1-8H,9H2,(H,19,20);/q;+1/p-1