3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfonylpropanoate

Systemtic Name: 3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfonylpropanoate Openeye Name: 3-(2-anilino-2-oxo-ethyl)sulfonylpropanoate CAS Name: 3-(2-anilino-2-oxoethyl)sulfonylpropanoate IUPAC Name: 3-(2-anilino-2-oxoethyl)sulfonylpropanoate Traditional Name: 3-(2-anilino-2-keto-ethyl)sulfonylpropionate Formula: C11H12NO5S- MolecularWeight: 270.28168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CS(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CS(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C11H13NO5S/c13-10(12-9-4-2-1-3-5-9)8-18(16,17)7-6-11(14)15/h1-5H,6-8H2,(H,12,13)(H,14,15)/p-1