4-ethyl-3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfonyl-benzoic acid

Systemtic Name: 4-ethyl-3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfonyl-benzoic acid Openeye Name: 4-ethyl-3-[2-(isopropylamino)-2-oxo-ethyl]sulfonyl-benzoic acid CAS Name: 4-ethyl-3-[2-oxo-2-(propan-2-ylamino)ethyl]sulfonylbenzoic acid IUPAC Name: 4-ethyl-3-[2-oxo-2-(propan-2-ylamino)ethyl]sulfonylbenzoic acid Traditional Name: 4-ethyl-3-[2-(isopropylamino)-2-keto-ethyl]sulfonyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC(=O)NC(C)C

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC(=O)NC(C)C

InChI

InChI=1S/C14H19NO5S/c1-4-10-5-6-11(14(17)18)7-12(10)21(19,20)8-13(16)15-9(2)3/h5-7,9H,4,8H2,1-3H3,(H,15,16)(H,17,18)