4-[3-[(E)-(2-butyl-1-benzofuran-3-yl)methylideneamino]oxypropoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[3-[(E)-(2-butyl-1-benzofuran-3-yl)methylideneamino]oxypropoxy]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-[(E)-(2-butylbenzofuran-3-yl)methyleneamino]oxypropoxy]-2-hydroxy-benzoic acid CAS Name: 4-[3-[(E)-(2-butyl-3-benzofuranyl)methylideneamino]oxypropoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[3-[(E)-(2-butyl-1-benzofuran-3-yl)methylideneamino]oxypropoxy]-2-hydroxybenzoic acid Traditional Name: 4-[3-[(E)-(2-butylbenzofuran-3-yl)methyleneamino]oxypropoxy]-2-hydroxy-benzoic acid Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C=NOCCCOC3=CC(=C(C=C3)C(=O)O)O

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)/C=N/OCCCOC3=CC(=C(C=C3)C(=O)O)O

InChI

InChI=1S/C23H25NO6/c1-2-3-8-22-19(17-7-4-5-9-21(17)30-22)15-24-29-13-6-12-28-16-10-11-18(23(26)27)20(25)14-16/h4-5,7,9-11,14-15,25H,2-3,6,8,12-13H2,1H3,(H,26,27)/b24-15+