[4-[[2-(3-chlorophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[[2-(3-chlorophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[[2-(3-chlorophenyl)-5-oxo-oxazol-4-ylidene]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[[2-(3-chlorophenyl)-5-oxo-4-oxazolylidene]methyl]phenyl] ester IUPAC Name: [4-[[2-(3-chlorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[[2-(3-chlorophenyl)-5-keto-2-oxazolin-4-ylidene]methyl]phenyl] ester Formula: C23H13ClN2O6 MolecularWeight: 448.81212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NC(=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)O2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NC(=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)O2

InChI

InChI=1S/C23H13ClN2O6/c24-17-5-1-3-15(12-17)21-25-20(23(28)32-21)11-14-7-9-19(10-8-14)31-22(27)16-4-2-6-18(13-16)26(29)30/h1-13H