2-[[4-(nitrooxymethyl)phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-(nitrooxymethyl)phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-(nitrooxymethyl)phenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-(nitrooxymethyl)anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(nitrooxymethyl)phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-(nitrooxymethyl)phenyl]carbamoyl]benzoic acid Formula: C15H12N2O6 MolecularWeight: 316.26558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)CO[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)CO[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H12N2O6/c18-14(12-3-1-2-4-13(12)15(19)20)16-11-7-5-10(6-8-11)9-23-17(21)22/h1-8H,9H2,(H,16,18)(H,19,20)