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

Systemtic Name: 3-(4-ethoxycarbonylphenyl)-4-[2-(3-oxidanyl-2-oxidanylidene-1H-indol-3-yl)ethanoyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(4-ethoxycarbonylphenyl)-4-[2-(3-hydroxy-2-oxo-indolin-3-yl)acetyl]oxadiazol-3-ium-5-olate CAS Name: 3-(4-ethoxycarbonylphenyl)-4-[2-(3-hydroxy-2-oxo-1H-indol-3-yl)-1-oxoethyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-(4-ethoxycarbonylphenyl)-4-[2-(3-hydroxy-2-oxo-1H-indol-3-yl)acetyl]oxadiazol-3-ium-5-olate Traditional Name: 3-(4-carbethoxyphenyl)-4-[2-(3-hydroxy-2-keto-indolin-3-yl)acetyl]oxadiazol-3-ium-5-olate Formula: C21H17N3O7 MolecularWeight: 423.37558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O7/c1-2-30-18(26)12-7-9-13(10-8-12)24-17(19(27)31-23-24)16(25)11-21(29)14-5-3-4-6-15(14)22-20(21)28/h3-10,29H,2,11H2,1H3,(H-,22,23,25,27,28)