(phenoxycarbonylamino) 4-nitrobenzenesulfonate

Systemtic Name: (phenoxycarbonylamino) 4-nitrobenzenesulfonate Openeye Name: (phenoxycarbonylamino) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [[oxo(phenoxy)methyl]amino] ester IUPAC Name: (phenoxycarbonylamino) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (carbophenoxyamino) ester Formula: C13H10N2O7S MolecularWeight: 338.2927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O7S/c16-13(21-11-4-2-1-3-5-11)14-22-23(19,20)12-8-6-10(7-9-12)15(17)18/h1-9H,(H,14,16)