3-[3-[ethyl-(4-fluorophenyl)sulfonyl-amino]indol-1-yl]propanoic acid

Systemtic Name: 3-[3-[ethyl-(4-fluorophenyl)sulfonyl-amino]indol-1-yl]propanoic acid Openeye Name: 3-[3-[ethyl-(4-fluorophenyl)sulfonyl-amino]indol-1-yl]propanoic acid CAS Name: 3-[3-[ethyl-(4-fluorophenyl)sulfonylamino]-1-indolyl]propanoic acid IUPAC Name: 3-[3-[ethyl-(4-fluorophenyl)sulfonylamino]indol-1-yl]propanoic acid Traditional Name: 3-[3-[ethyl-(4-fluorophenyl)sulfonyl-amino]indol-1-yl]propionic acid Formula: C19H19FN2O4S MolecularWeight: 390.428563

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CN(C2=CC=CC=C21)CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(C1=CN(C2=CC=CC=C21)CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2O4S/c1-2-22(27(25,26)15-9-7-14(20)8-10-15)18-13-21(12-11-19(23)24)17-6-4-3-5-16(17)18/h3-10,13H,2,11-12H2,1H3,(H,23,24)