4-chloranyl-2-[[5-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-ylidene]methylamino]benzoate

Systemtic Name: 4-chloranyl-2-[[5-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-ylidene]methylamino]benzoate Openeye Name: 4-chloro-2-[[5-oxo-2-(3,4,5-trimethoxyphenyl)oxazol-4-ylidene]methylamino]benzoate CAS Name: 4-chloro-2-[[5-oxo-2-(3,4,5-trimethoxyphenyl)-4-oxazolylidene]methylamino]benzoate IUPAC Name: 4-chloro-2-[[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-ylidene]methylamino]benzoate Traditional Name: 4-chloro-2-[[5-keto-2-(3,4,5-trimethoxyphenyl)-2-oxazolin-4-ylidene]methylamino]benzoate Formula: C20H16ClN2O7- MolecularWeight: 431.80324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC(=CNC3=C(C=CC(=C3)Cl)C(=O)[O-])C(=O)O2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC(=CNC3=C(C=CC(=C3)Cl)C(=O)[O-])C(=O)O2

InChI

InChI=1S/C20H17ClN2O7/c1-27-15-6-10(7-16(28-2)17(15)29-3)18-23-14(20(26)30-18)9-22-13-8-11(21)4-5-12(13)19(24)25/h4-9,22H,1-3H3,(H,24,25)/p-1