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

Systemtic Name: [4-[(5-oxidanylidene-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 2-nitrobenzenesulfonate Openeye Name: [4-[(5-oxo-2-phenyl-oxazol-4-ylidene)methyl]phenyl] 2-nitrobenzenesulfonate CAS Name: 2-nitrobenzenesulfonic acid [4-[(5-oxo-2-phenyl-4-oxazolylidene)methyl]phenyl] ester IUPAC Name: [4-[(5-oxo-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 2-nitrobenzenesulfonate Traditional Name: 2-nitrobenzenesulfonic acid [4-[(5-keto-2-phenyl-2-oxazolin-4-ylidene)methyl]phenyl] ester Formula: C22H14N2O7S MolecularWeight: 450.42076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H14N2O7S/c25-22-18(23-21(30-22)16-6-2-1-3-7-16)14-15-10-12-17(13-11-15)31-32(28,29)20-9-5-4-8-19(20)24(26)27/h1-14H