3-[(4-ethylphenyl)-propylsulfonyl-amino]propanoic acid

Systemtic Name: 3-[(4-ethylphenyl)-propylsulfonyl-amino]propanoic acid Openeye Name: 3-(4-ethyl-N-propylsulfonyl-anilino)propanoic acid CAS Name: 3-(4-ethyl-N-propylsulfonylanilino)propanoic acid IUPAC Name: 3-(4-ethyl-N-propylsulfonylanilino)propanoic acid Traditional Name: 3-(4-ethyl-N-propylsulfonyl-anilino)propionic acid Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CCC(=O)O)C1=CC=C(C=C1)CC

Isomeric SMILES

CCCS(=O)(=O)N(CCC(=O)O)C1=CC=C(C=C1)CC

InChI

InChI=1S/C14H21NO4S/c1-3-11-20(18,19)15(10-9-14(16)17)13-7-5-12(4-2)6-8-13/h5-8H,3-4,9-11H2,1-2H3,(H,16,17)