2-[3-methoxy-4-[5-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-methoxy-4-[5-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-yl]phenoxy]ethanoic acid Openeye Name: 2-[3-methoxy-4-[5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-yl]phenoxy]acetic acid CAS Name: 2-[3-methoxy-4-[5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-yl]phenoxy]acetic acid IUPAC Name: 2-[3-methoxy-4-[5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-yl]phenoxy]acetic acid Traditional Name: 2-[4-[5-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-yl]-3-methoxy-phenoxy]acetic acid Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC(=O)O)C2=CC3=C(N2)C=CC(=C3)C4=NNC(=O)CC4

Isomeric SMILES

COC1=C(C=CC(=C1)OCC(=O)O)C2=CC3=C(N2)C=CC(=C3)C4=NNC(=O)CC4

InChI

InChI=1S/C21H19N3O5/c1-28-19-10-14(29-11-21(26)27)3-4-15(19)18-9-13-8-12(2-5-16(13)22-18)17-6-7-20(25)24-23-17/h2-5,8-10,22H,6-7,11H2,1H3,(H,24,25)(H,26,27)