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

Systemtic Name: 3-[[1-(2,2-diphenylethanoyl)piperidin-4-ylidene]methyl]benzoic acid Openeye Name: 3-[[1-(2,2-diphenylacetyl)-4-piperidylidene]methyl]benzoic acid CAS Name: 3-[[1-(1-oxo-2,2-diphenylethyl)-4-piperidinylidene]methyl]benzoic acid IUPAC Name: 3-[[1-(2,2-diphenylacetyl)piperidin-4-ylidene]methyl]benzoic acid Traditional Name: 3-[[1-(2,2-diphenylacetyl)-4-piperidylidene]methyl]benzoic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25NO3/c29-26(25(22-9-3-1-4-10-22)23-11-5-2-6-12-23)28-16-14-20(15-17-28)18-21-8-7-13-24(19-21)27(30)31/h1-13,18-19,25H,14-17H2,(H,30,31)