3-(4-fluorophenyl)-3-(5-nitro-1H-indol-3-yl)propanoic acid

Systemtic Name: 3-(4-fluorophenyl)-3-(5-nitro-1H-indol-3-yl)propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-(5-nitro-1H-indol-3-yl)propanoic acid CAS Name: 3-(4-fluorophenyl)-3-(5-nitro-1H-indol-3-yl)propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-(5-nitro-1H-indol-3-yl)propanoic acid Traditional Name: 3-(4-fluorophenyl)-3-(5-nitro-1H-indol-3-yl)propionic acid Formula: C17H13FN2O4 MolecularWeight: 328.294523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C17H13FN2O4/c18-11-3-1-10(2-4-11)13(8-17(21)22)15-9-19-16-6-5-12(20(23)24)7-14(15)16/h1-7,9,13,19H,8H2,(H,21,22)