3-(2,5-dimethylphenyl)-4-[2-(3-oxidanyl-2-oxidanylidene-1H-indol-3-yl)ethanoyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(2,5-dimethylphenyl)-4-[2-(3-oxidanyl-2-oxidanylidene-1H-indol-3-yl)ethanoyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(2,5-dimethylphenyl)-4-[2-(3-hydroxy-2-oxo-indolin-3-yl)acetyl]oxadiazol-3-ium-5-olate CAS Name: 3-(2,5-dimethylphenyl)-4-[2-(3-hydroxy-2-oxo-1H-indol-3-yl)-1-oxoethyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-(2,5-dimethylphenyl)-4-[2-(3-hydroxy-2-oxo-1H-indol-3-yl)acetyl]oxadiazol-3-ium-5-olate Traditional Name: 3-(2,5-dimethylphenyl)-4-[2-(3-hydroxy-2-keto-indolin-3-yl)acetyl]oxadiazol-3-ium-5-olate Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)[N+]2=NOC(=C2C(=O)CC3(C4=CC=CC=C4NC3=O)O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)[N+]2=NOC(=C2C(=O)CC3(C4=CC=CC=C4NC3=O)O)[O-]

InChI

InChI=1S/C20H17N3O5/c1-11-7-8-12(2)15(9-11)23-17(18(25)28-22-23)16(24)10-20(27)13-5-3-4-6-14(13)21-19(20)26/h3-9,27H,10H2,1-2H3,(H-,21,22,24,25,26)