4-[4-[(2-cyanophenyl)methylidene]piperidin-1-yl]benzoic acid

Systemtic Name: 4-[4-[(2-cyanophenyl)methylidene]piperidin-1-yl]benzoic acid Openeye Name: 4-[4-[(2-cyanophenyl)methylene]-1-piperidyl]benzoic acid CAS Name: 4-[4-[(2-cyanophenyl)methylidene]-1-piperidinyl]benzoic acid IUPAC Name: 4-[4-[(2-cyanophenyl)methylidene]piperidin-1-yl]benzoic acid Traditional Name: 4-[4-(2-cyanobenzylidene)piperidino]benzoic acid Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=CC2=CC=CC=C2C#N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1=CC2=CC=CC=C2C#N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N2O2/c21-14-18-4-2-1-3-17(18)13-15-9-11-22(12-10-15)19-7-5-16(6-8-19)20(23)24/h1-8,13H,9-12H2,(H,23,24)