[2-(nitrooxymethyl)phenyl] 4-sulfamoylbenzoate

Systemtic Name: [2-(nitrooxymethyl)phenyl] 4-sulfamoylbenzoate Openeye Name: [2-(nitrooxymethyl)phenyl] 4-sulfamoylbenzoate CAS Name: 4-sulfamoylbenzoic acid [2-(nitrooxymethyl)phenyl] ester IUPAC Name: [2-(nitrooxymethyl)phenyl] 4-sulfamoylbenzoate Traditional Name: 4-sulfamoylbenzoic acid [2-(nitrooxymethyl)phenyl] ester Formula: C14H12N2O7S MolecularWeight: 352.31928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O7S/c15-24(20,21)12-7-5-10(6-8-12)14(17)23-13-4-2-1-3-11(13)9-22-16(18)19/h1-8H,9H2,(H2,15,20,21)