2-[[3-(4-nitrophenyl)-3-oxidanylidene-propyl]amino]ethanoic acid

Systemtic Name: 2-[[3-(4-nitrophenyl)-3-oxidanylidene-propyl]amino]ethanoic acid Openeye Name: 2-[[3-(4-nitrophenyl)-3-oxo-propyl]amino]acetic acid CAS Name: 2-[[3-(4-nitrophenyl)-3-oxopropyl]amino]acetic acid IUPAC Name: 2-[[3-(4-nitrophenyl)-3-oxopropyl]amino]acetic acid Traditional Name: 2-[[3-keto-3-(4-nitrophenyl)propyl]amino]acetic acid Formula: C11H12N2O5 MolecularWeight: 252.22338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCNCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCNCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O5/c14-10(5-6-12-7-11(15)16)8-1-3-9(4-2-8)13(17)18/h1-4,12H,5-7H2,(H,15,16)