2-azanyl-5-[[4-azanyl-3-(dioxidanylmethyl)phenyl]methyl]benzoic acid

Systemtic Name: 2-azanyl-5-[[4-azanyl-3-(dioxidanylmethyl)phenyl]methyl]benzoic acid Openeye Name: 2-amino-5-[[4-amino-3-(hydroperoxymethyl)phenyl]methyl]benzoic acid CAS Name: 2-amino-5-[[4-amino-3-(hydroperoxymethyl)phenyl]methyl]benzoic acid IUPAC Name: 2-amino-5-[[4-amino-3-(hydroperoxymethyl)phenyl]methyl]benzoic acid Traditional Name: 2-amino-5-[4-amino-3-(hydroperoxymethyl)benzyl]benzoic acid Formula: C15H16N2O4 MolecularWeight: 288.29854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)C(=O)O)COO)N

Isomeric SMILES

C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)C(=O)O)COO)N

InChI

InChI=1S/C15H16N2O4/c16-13-3-1-9(6-11(13)8-21-20)5-10-2-4-14(17)12(7-10)15(18)19/h1-4,6-7,20H,5,8,16-17H2,(H,18,19)