6-[[4-(4-azanylphenoxy)phenyl]carbamoyl]-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylic acid

Systemtic Name: 6-[[4-(4-azanylphenoxy)phenyl]carbamoyl]-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylic acid Openeye Name: 6-[[4-(4-aminophenoxy)phenyl]carbamoyl]-1,3-dioxo-isobenzofuran-5-carboxylic acid CAS Name: 6-[[4-(4-aminophenoxy)anilino]-oxomethyl]-1,3-dioxo-5-isobenzofurancarboxylic acid IUPAC Name: 6-[[4-(4-aminophenoxy)phenyl]carbamoyl]-1,3-dioxo-2-benzofuran-5-carboxylic acid Traditional Name: 6-[[4-(4-aminophenoxy)phenyl]carbamoyl]-1,3-diketo-phthalan-5-carboxylic acid Formula: C22H14N2O7 MolecularWeight: 418.35576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)OC2=CC=C(C=C2)NC(=O)C3=C(C=C4C(=C3)C(=O)OC4=O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)OC2=CC=C(C=C2)NC(=O)C3=C(C=C4C(=C3)C(=O)OC4=O)C(=O)O

InChI

InChI=1S/C22H14N2O7/c23-11-1-5-13(6-2-11)30-14-7-3-12(4-8-14)24-19(25)15-9-17-18(10-16(15)20(26)27)22(29)31-21(17)28/h1-10H,23H2,(H,24,25)(H,26,27)