3-[3-[2-(phenylsulfonylamino)ethyl]indol-1-yl]propanoic acid

Systemtic Name: 3-[3-[2-(phenylsulfonylamino)ethyl]indol-1-yl]propanoic acid Openeye Name: 3-[3-[2-(benzenesulfonamido)ethyl]indol-1-yl]propanoic acid CAS Name: 3-[3-[2-(benzenesulfonamido)ethyl]-1-indolyl]propanoic acid IUPAC Name: 3-[3-[2-(benzenesulfonamido)ethyl]indol-1-yl]propanoic acid Traditional Name: 3-[3-[2-(benzenesulfonamido)ethyl]indol-1-yl]propionic acid Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCC2=CN(C3=CC=CC=C32)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCC2=CN(C3=CC=CC=C32)CCC(=O)O

InChI

InChI=1S/C19H20N2O4S/c22-19(23)11-13-21-14-15(17-8-4-5-9-18(17)21)10-12-20-26(24,25)16-6-2-1-3-7-16/h1-9,14,20H,10-13H2,(H,22,23)