2-[(3-methyl-1-benzofuran-2-yl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(3-methyl-1-benzofuran-2-yl)carbonylamino]terephthalic acid Openeye Name: 2-[(3-methylbenzofuran-2-carbonyl)amino]terephthalic acid CAS Name: 2-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(3-methyl-1-benzofuran-2-carbonyl)amino]terephthalic acid Traditional Name: 2-[(3-methylbenzofuran-2-carbonyl)amino]terephthalic acid Formula: C18H13NO6 MolecularWeight: 339.29892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C18H13NO6/c1-9-11-4-2-3-5-14(11)25-15(9)16(20)19-13-8-10(17(21)22)6-7-12(13)18(23)24/h2-8H,1H3,(H,19,20)(H,21,22)(H,23,24)