[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 2-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]benzoate CAS Name: 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]benzoic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C22H18N2O9S MolecularWeight: 486.45132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O9S/c1-32-15-8-6-14(7-9-15)21(26)13-33-22(27)17-4-2-3-5-18(17)23-34(30,31)16-10-11-20(25)19(12-16)24(28)29/h2-12,23,25H,13H2,1H3