[4-(nitrooxymethyl)phenyl]methyl 4-sulfamoylbenzoate

Systemtic Name: [4-(nitrooxymethyl)phenyl]methyl 4-sulfamoylbenzoate Openeye Name: [4-(nitrooxymethyl)phenyl]methyl 4-sulfamoylbenzoate CAS Name: 4-sulfamoylbenzoic acid [4-(nitrooxymethyl)phenyl]methyl ester IUPAC Name: [4-(nitrooxymethyl)phenyl]methyl 4-sulfamoylbenzoate Traditional Name: 4-sulfamoylbenzoic acid [4-(nitrooxymethyl)benzyl] ester Formula: C15H14N2O7S MolecularWeight: 366.34586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)S(=O)(=O)N)CO[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)S(=O)(=O)N)CO[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O7S/c16-25(21,22)14-7-5-13(6-8-14)15(18)23-9-11-1-3-12(4-2-11)10-24-17(19)20/h1-8H,9-10H2,(H2,16,21,22)