5-acetyloxy-4-ethyl-2-[2-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanoyl]phenolate

Systemtic Name: 5-acetyloxy-4-ethyl-2-[2-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanoyl]phenolate Openeye Name: 5-acetoxy-4-ethyl-2-[2-(5-phenyl-1,3,4-thiadiazol-2-yl)acetyl]phenolate CAS Name: 5-acetyloxy-4-ethyl-2-[1-oxo-2-(5-phenyl-1,3,4-thiadiazol-2-yl)ethyl]phenolate IUPAC Name: 5-acetyloxy-4-ethyl-2-[2-(5-phenyl-1,3,4-thiadiazol-2-yl)acetyl]phenolate Traditional Name: 5-acetoxy-4-ethyl-2-[2-(5-phenyl-1,3,4-thiadiazol-2-yl)acetyl]phenolate Formula: C20H17N2O4S- MolecularWeight: 381.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)CC2=NN=C(S2)C3=CC=CC=C3)[O-])OC(=O)C

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)CC2=NN=C(S2)C3=CC=CC=C3)[O-])OC(=O)C

InChI

InChI=1S/C20H18N2O4S/c1-3-13-9-15(16(24)10-18(13)26-12(2)23)17(25)11-19-21-22-20(27-19)14-7-5-4-6-8-14/h4-10,24H,3,11H2,1-2H3/p-1