[4-[(ethoxycarbonylamino)carbamoyl]phenyl] 3-nitrobenzenesulfonate

Systemtic Name: [4-[(ethoxycarbonylamino)carbamoyl]phenyl] 3-nitrobenzenesulfonate Openeye Name: [4-[(ethoxycarbonylamino)carbamoyl]phenyl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [4-[(ethoxycarbonylhydrazo)-oxomethyl]phenyl] ester IUPAC Name: [4-[(ethoxycarbonylamino)carbamoyl]phenyl] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [4-[(carbethoxyamino)carbamoyl]phenyl] ester Formula: C16H15N3O8S MolecularWeight: 409.3706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)NNC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O8S/c1-2-26-16(21)18-17-15(20)11-6-8-13(9-7-11)27-28(24,25)14-5-3-4-12(10-14)19(22)23/h3-10H,2H2,1H3,(H,17,20)(H,18,21)