5-[1-(4-methylsulfonylphenyl)ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[1-(4-methylsulfonylphenyl)ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[1-(4-methylsulfonylphenyl)ethylamino]-5-oxo-pentanoic acid CAS Name: 5-[1-(4-methylsulfonylphenyl)ethylamino]-5-oxopentanoic acid IUPAC Name: 5-[1-(4-methylsulfonylphenyl)ethylamino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[1-(4-mesylphenyl)ethylamino]valeric acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CCCC(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CCCC(=O)O

InChI

InChI=1S/C14H19NO5S/c1-10(15-13(16)4-3-5-14(17)18)11-6-8-12(9-7-11)21(2,19)20/h6-10H,3-5H2,1-2H3,(H,15,16)(H,17,18)