3-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfonylphenyl]propanoic acid

Systemtic Name: 3-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfonylphenyl]propanoic acid Openeye Name: 3-[4-[2-(cyclopropylamino)-2-oxo-ethyl]sulfonylphenyl]propanoic acid CAS Name: 3-[4-[2-(cyclopropylamino)-2-oxoethyl]sulfonylphenyl]propanoic acid IUPAC Name: 3-[4-[2-(cyclopropylamino)-2-oxoethyl]sulfonylphenyl]propanoic acid Traditional Name: 3-[4-[2-(cyclopropylamino)-2-keto-ethyl]sulfonylphenyl]propionic acid Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

C1CC1NC(=O)CS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C14H17NO5S/c16-13(15-11-4-5-11)9-21(19,20)12-6-1-10(2-7-12)3-8-14(17)18/h1-2,6-7,11H,3-5,8-9H2,(H,15,16)(H,17,18)