[3-(dimethylcarbamoyl)phenyl] 2-methoxy-5-nitro-benzenesulfonate

Systemtic Name: [3-(dimethylcarbamoyl)phenyl] 2-methoxy-5-nitro-benzenesulfonate Openeye Name: [3-(dimethylcarbamoyl)phenyl] 2-methoxy-5-nitro-benzenesulfonate CAS Name: 2-methoxy-5-nitrobenzenesulfonic acid [3-[dimethylamino(oxo)methyl]phenyl] ester IUPAC Name: [3-(dimethylcarbamoyl)phenyl] 2-methoxy-5-nitrobenzenesulfonate Traditional Name: 2-methoxy-5-nitro-benzenesulfonic acid [3-(dimethylcarbamoyl)phenyl] ester Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H16N2O7S/c1-17(2)16(19)11-5-4-6-13(9-11)25-26(22,23)15-10-12(18(20)21)7-8-14(15)24-3/h4-10H,1-3H3