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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=NOC2=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=C2C(=NOC2=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

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