2-[(5-chloranyl-1-benzofuran-2-yl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(5-chloranyl-1-benzofuran-2-yl)carbonylamino]terephthalic acid Openeye Name: 2-[(5-chlorobenzofuran-2-carbonyl)amino]terephthalic acid CAS Name: 2-[[(5-chloro-2-benzofuranyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(5-chloro-1-benzofuran-2-carbonyl)amino]terephthalic acid Traditional Name: 2-[(5-chlorobenzofuran-2-carbonyl)amino]terephthalic acid Formula: C17H10ClNO6 MolecularWeight: 359.7174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC3=C(O2)C=CC(=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC3=C(O2)C=CC(=C3)Cl)C(=O)O

InChI

InChI=1S/C17H10ClNO6/c18-10-2-4-13-9(5-10)7-14(25-13)15(20)19-12-6-8(16(21)22)1-3-11(12)17(23)24/h1-7H,(H,19,20)(H,21,22)(H,23,24)