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

Systemtic Name: 3-[4-(2-azanyl-2-oxidanylidene-ethyl)sulfonylphenyl]propanoic acid Openeye Name: 3-[4-(2-amino-2-oxo-ethyl)sulfonylphenyl]propanoic acid CAS Name: 3-[4-(2-amino-2-oxoethyl)sulfonylphenyl]propanoic acid IUPAC Name: 3-[4-(2-amino-2-oxoethyl)sulfonylphenyl]propanoic acid Traditional Name: 3-[4-(2-amino-2-keto-ethyl)sulfonylphenyl]propionic acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)CC(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)CC(=O)N

InChI

InChI=1S/C11H13NO5S/c12-10(13)7-18(16,17)9-4-1-8(2-5-9)3-6-11(14)15/h1-2,4-5H,3,6-7H2,(H2,12,13)(H,14,15)