3-[5-oxidanyl-3-[2-(phenylsulfonylamino)ethyl]indol-1-yl]propanoic acid

Systemtic Name: 3-[5-oxidanyl-3-[2-(phenylsulfonylamino)ethyl]indol-1-yl]propanoic acid Openeye Name: 3-[3-[2-(benzenesulfonamido)ethyl]-5-hydroxy-indol-1-yl]propanoic acid CAS Name: 3-[3-[2-(benzenesulfonamido)ethyl]-5-hydroxy-1-indolyl]propanoic acid IUPAC Name: 3-[3-[2-(benzenesulfonamido)ethyl]-5-hydroxyindol-1-yl]propanoic acid Traditional Name: 3-[3-[2-(benzenesulfonamido)ethyl]-5-hydroxy-indol-1-yl]propionic acid Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCC2=CN(C3=C2C=C(C=C3)O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCC2=CN(C3=C2C=C(C=C3)O)CCC(=O)O

InChI

InChI=1S/C19H20N2O5S/c22-15-6-7-18-17(12-15)14(13-21(18)11-9-19(23)24)8-10-20-27(25,26)16-4-2-1-3-5-16/h1-7,12-13,20,22H,8-11H2,(H,23,24)