5-chloranyl-2-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 5-chloranyl-2-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 5-chloro-2-[2-[4-(4-fluorobenzoyl)-1-piperidyl]-2-oxo-ethoxy]benzoic acid CAS Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-oxoethoxy]benzoic acid IUPAC Name: 5-chloro-2-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]-2-oxoethoxy]benzoic acid Traditional Name: 5-chloro-2-[2-[4-(4-fluorobenzoyl)piperidino]-2-keto-ethoxy]benzoic acid Formula: C21H19ClFNO5 MolecularWeight: 419.830663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)C(=O)COC3=C(C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)C(=O)COC3=C(C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H19ClFNO5/c22-15-3-6-18(17(11-15)21(27)28)29-12-19(25)24-9-7-14(8-10-24)20(26)13-1-4-16(23)5-2-13/h1-6,11,14H,7-10,12H2,(H,27,28)