3-(1-benzofuran-2-ylmethylamino)phthalic acid

Systemtic Name: 3-(1-benzofuran-2-ylmethylamino)phthalic acid Openeye Name: 3-(benzofuran-2-ylmethylamino)phthalic acid CAS Name: 3-(2-benzofuranylmethylamino)phthalic acid IUPAC Name: 3-(1-benzofuran-2-ylmethylamino)phthalic acid Traditional Name: 3-(benzofuran-2-ylmethylamino)phthalic acid Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)CNC3=CC=CC(=C3C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)CNC3=CC=CC(=C3C(=O)O)C(=O)O

InChI

InChI=1S/C17H13NO5/c19-16(20)12-5-3-6-13(15(12)17(21)22)18-9-11-8-10-4-1-2-7-14(10)23-11/h1-8,18H,9H2,(H,19,20)(H,21,22)