2-[4-(3-methoxy-1H-pyrrol-2-yl)-1-oxidanyl-4-(2-oxidanylidene-1,7a-dihydroindol-4-yl)cyclobut-2-yn-1-yl]-2-phenoxy-ethanoic acid

Systemtic Name: 2-[4-(3-methoxy-1H-pyrrol-2-yl)-1-oxidanyl-4-(2-oxidanylidene-1,7a-dihydroindol-4-yl)cyclobut-2-yn-1-yl]-2-phenoxy-ethanoic acid Openeye Name: 2-[1-hydroxy-4-(3-methoxy-1H-pyrrol-2-yl)-4-(2-oxo-1,7a-dihydroindol-4-yl)cyclobut-2-yn-1-yl]-2-phenoxy-acetic acid CAS Name: 2-[1-hydroxy-4-(3-methoxy-1H-pyrrol-2-yl)-4-(2-oxo-1,7a-dihydroindol-4-yl)-1-cyclobut-2-ynyl]-2-phenoxyacetic acid IUPAC Name: 2-[1-hydroxy-4-(3-methoxy-1H-pyrrol-2-yl)-4-(2-oxo-1,7a-dihydroindol-4-yl)cyclobut-2-yn-1-yl]-2-phenoxyacetic acid Traditional Name: 2-[1-hydroxy-4-(2-keto-1,7a-dihydroindol-4-yl)-4-(3-methoxy-1H-pyrrol-2-yl)cyclobut-2-yn-1-yl]-2-phenoxy-acetic acid Formula: C25H20N2O6 MolecularWeight: 444.4361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC=C1)C2(C#CC2(C(C(=O)O)OC3=CC=CC=C3)O)C4=CC=CC5C4=CC(=O)N5

Isomeric SMILES

COC1=C(NC=C1)C2(C#CC2(C(C(=O)O)OC3=CC=CC=C3)O)C4=CC=CC5C4=CC(=O)N5

InChI

InChI=1S/C25H20N2O6/c1-32-19-10-13-26-21(19)24(17-8-5-9-18-16(17)14-20(28)27-18)11-12-25(24,31)22(23(29)30)33-15-6-3-2-4-7-15/h2-10,13-14,18,22,26,31H,1H3,(H,27,28)(H,29,30)