2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid IUPAC Name: 2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C18H19FN2O4 MolecularWeight: 346.352863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)C3C4C=CC(C3C(=O)O)O4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)C3C4C=CC(C3C(=O)O)O4

InChI

InChI=1S/C18H19FN2O4/c19-11-3-1-2-4-12(11)20-7-9-21(10-8-20)17(22)15-13-5-6-14(25-13)16(15)18(23)24/h1-6,13-16H,7-10H2,(H,23,24)