3-(5-fluoranyl-1H-indol-3-yl)-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-(5-fluoranyl-1H-indol-3-yl)-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]propanoic acid Openeye Name: 3-(5-fluoro-1H-indol-3-yl)-2-[[4-(4-pyridyloxy)phenyl]sulfonylamino]propanoic acid CAS Name: 3-(5-fluoro-1H-indol-3-yl)-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-(5-fluoro-1H-indol-3-yl)-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-(5-fluoro-1H-indol-3-yl)-2-[[4-(4-pyridyloxy)phenyl]sulfonylamino]propionic acid Formula: C22H18FN3O5S MolecularWeight: 455.458823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CC=NC=C2)S(=O)(=O)NC(CC3=CNC4=C3C=C(C=C4)F)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1OC2=CC=NC=C2)S(=O)(=O)NC(CC3=CNC4=C3C=C(C=C4)F)C(=O)O

InChI

InChI=1S/C22H18FN3O5S/c23-15-1-6-20-19(12-15)14(13-25-20)11-21(22(27)28)26-32(29,30)18-4-2-16(3-5-18)31-17-7-9-24-10-8-17/h1-10,12-13,21,25-26H,11H2,(H,27,28)