(3E)-3-[(2-methylpyrazol-3-yl)methylidene]-1-(triphenylmethyl)piperidin-4-one

Systemtic Name: (3E)-3-[(2-methylpyrazol-3-yl)methylidene]-1-(triphenylmethyl)piperidin-4-one Openeye Name: (3E)-3-[(2-methylpyrazol-3-yl)methylene]-1-trityl-piperidin-4-one CAS Name: (3E)-3-[(2-methyl-3-pyrazolyl)methylidene]-1-(triphenylmethyl)-4-piperidinone IUPAC Name: (3E)-3-[(2-methylpyrazol-3-yl)methylidene]-1-tritylpiperidin-4-one Traditional Name: (3E)-3-[(2-methylpyrazol-3-yl)methylene]-1-trityl-4-piperidone Formula: C29H27N3O MolecularWeight: 433.54418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C=C2CN(CCC2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=CC=N1)/C=C/2\CN(CCC2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O/c1-31-27(17-19-30-31)21-23-22-32(20-18-28(23)33)29(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-17,19,21H,18,20,22H2,1H3/b23-21+