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2-[(2-oxidanidyl-2-oxidanylidene-ethyl)-phenethyl-azaniumyl]ethanoate

2-[(2-oxidanidyl-2-oxidanylidene-ethyl)-phenethyl-azaniumyl]ethanoate

Systemtic Name:2-[(2-oxidanidyl-2-oxidanylidene-ethyl)-phenethyl-azaniumyl]ethanoate
Openeye Name:2-[(2-oxido-2-oxo-ethyl)-phenethyl-ammonio]acetate
CAS Name:2-[(2-oxido-2-oxoethyl)-phenethylammonio]acetate
IUPAC Name:2-[(2-oxido-2-oxoethyl)-phenethylazaniumyl]acetate
Traditional Name:2-[(2-keto-2-oxido-ethyl)-phenethyl-ammonio]acetate
Formula: C12H14NO4-
MolecularWeight: 236.24386
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H15NO4/c14-11(15)8-13(9-12(16)17)7-6-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,14,15)(H,16,17)/p-1


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