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

Systemtic Name: [2-methoxy-4-[(5-oxidanylidene-2-thiophen-2-yl-1,3-oxazol-4-ylidene)methyl]phenyl] 2-nitrobenzenesulfonate Openeye Name: [2-methoxy-4-[[5-oxo-2-(2-thienyl)oxazol-4-ylidene]methyl]phenyl] 2-nitrobenzenesulfonate CAS Name: 2-nitrobenzenesulfonic acid [2-methoxy-4-[(5-oxo-2-thiophen-2-yl-4-oxazolylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(5-oxo-2-thiophen-2-yl-1,3-oxazol-4-ylidene)methyl]phenyl] 2-nitrobenzenesulfonate Traditional Name: 2-nitrobenzenesulfonic acid [4-[[5-keto-2-(2-thienyl)-2-oxazolin-4-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C21H14N2O8S2 MolecularWeight: 486.47446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=CS3)OS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=CS3)OS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O8S2/c1-29-17-12-13(11-14-21(24)30-20(22-14)18-6-4-10-32-18)8-9-16(17)31-33(27,28)19-7-3-2-5-15(19)23(25)26/h2-12H,1H3