(2R)-2-[(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]-3-phenyl-propanoate Openeye Name: (2R)-2-[(2-oxido-2-oxo-ethyl)ammonio]-3-phenyl-propanoate CAS Name: (2R)-2-[(2-oxido-2-oxoethyl)ammonio]-3-phenylpropanoate IUPAC Name: (2R)-2-[(2-oxido-2-oxoethyl)azaniumyl]-3-phenylpropanoate Traditional Name: (2R)-2-[(2-keto-2-oxido-ethyl)ammonio]-3-phenyl-propionate Formula: C11H12NO4- MolecularWeight: 222.21728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])[NH2+]CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)[O-])[NH2+]CC(=O)[O-]

InChI

InChI=1S/C11H13NO4/c13-10(14)7-12-9(11(15)16)6-8-4-2-1-3-5-8/h1-5,9,12H,6-7H2,(H,13,14)(H,15,16)/p-1/t9-/m1/s1