[3-(ethoxycarbonylamino)phenyl] 2-methyl-3-nitro-benzenesulfonate

Systemtic Name: [3-(ethoxycarbonylamino)phenyl] 2-methyl-3-nitro-benzenesulfonate Openeye Name: [3-(ethoxycarbonylamino)phenyl] 2-methyl-3-nitro-benzenesulfonate CAS Name: 2-methyl-3-nitrobenzenesulfonic acid [3-(ethoxycarbonylamino)phenyl] ester IUPAC Name: [3-(ethoxycarbonylamino)phenyl] 2-methyl-3-nitrobenzenesulfonate Traditional Name: 2-methyl-3-nitro-benzenesulfonic acid [3-(carbethoxyamino)phenyl] ester Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC(=CC=C1)OS(=O)(=O)C2=CC=CC(=C2C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)NC1=CC(=CC=C1)OS(=O)(=O)C2=CC=CC(=C2C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O7S/c1-3-24-16(19)17-12-6-4-7-13(10-12)25-26(22,23)15-9-5-8-14(11(15)2)18(20)21/h4-10H,3H2,1-2H3,(H,17,19)