4-[bis(3-oxidanylidene-1H-2-benzofuran-1-yl)amino]butanoic acid

Systemtic Name: 4-[bis(3-oxidanylidene-1H-2-benzofuran-1-yl)amino]butanoic acid Openeye Name: 4-[bis(3-oxo-1H-isobenzofuran-1-yl)amino]butanoic acid CAS Name: 4-[bis(3-oxo-1H-isobenzofuran-1-yl)amino]butanoic acid IUPAC Name: 4-[bis(3-oxo-1H-2-benzofuran-1-yl)amino]butanoic acid Traditional Name: 4-(diphthalidylamino)butyric acid Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)N(CCCC(=O)O)C3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)N(CCCC(=O)O)C3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C20H17NO6/c22-16(23)10-5-11-21(17-12-6-1-3-8-14(12)19(24)26-17)18-13-7-2-4-9-15(13)20(25)27-18/h1-4,6-9,17-18H,5,10-11H2,(H,22,23)