4-[[1-(2,2-diphenylethanoyl)piperidin-4-ylidene]methyl]-3-fluoranyl-benzoic acid

Systemtic Name: 4-[[1-(2,2-diphenylethanoyl)piperidin-4-ylidene]methyl]-3-fluoranyl-benzoic acid Openeye Name: 4-[[1-(2,2-diphenylacetyl)-4-piperidylidene]methyl]-3-fluoro-benzoic acid CAS Name: 3-fluoro-4-[[1-(1-oxo-2,2-diphenylethyl)-4-piperidinylidene]methyl]benzoic acid IUPAC Name: 4-[[1-(2,2-diphenylacetyl)piperidin-4-ylidene]methyl]-3-fluorobenzoic acid Traditional Name: 4-[[1-(2,2-diphenylacetyl)-4-piperidylidene]methyl]-3-fluoro-benzoic acid Formula: C27H24FNO3 MolecularWeight: 429.482763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=CC2=C(C=C(C=C2)C(=O)O)F)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1=CC2=C(C=C(C=C2)C(=O)O)F)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H24FNO3/c28-24-18-23(27(31)32)12-11-22(24)17-19-13-15-29(16-14-19)26(30)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,17-18,25H,13-16H2,(H,31,32)