methyl 3-[2-[3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[(2-methoxy-5-nitrophenyl)sulfonylamino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(2-methoxy-5-nitrophenyl)sulfonylamino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]phenyl]ethynyl]benzoic acid methyl ester Formula: C23H18N2O7S MolecularWeight: 466.46322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C23H18N2O7S/c1-31-21-12-11-20(25(27)28)15-22(21)33(29,30)24-19-8-4-6-17(14-19)10-9-16-5-3-7-18(13-16)23(26)32-2/h3-8,11-15,24H,1-2H3