(3E)-3-[(2,5-dimethylpyrazol-3-yl)methylidene]-1-(triphenylmethyl)piperidin-4-one

Systemtic Name: (3E)-3-[(2,5-dimethylpyrazol-3-yl)methylidene]-1-(triphenylmethyl)piperidin-4-one Openeye Name: (3E)-3-[(2,5-dimethylpyrazol-3-yl)methylene]-1-trityl-piperidin-4-one CAS Name: (3E)-3-[(2,5-dimethyl-3-pyrazolyl)methylidene]-1-(triphenylmethyl)-4-piperidinone IUPAC Name: (3E)-3-[(2,5-dimethylpyrazol-3-yl)methylidene]-1-tritylpiperidin-4-one Traditional Name: (3E)-3-[(2,5-dimethylpyrazol-3-yl)methylene]-1-trityl-4-piperidone Formula: C30H29N3O MolecularWeight: 447.57076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C=C2CN(CCC2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=NN(C(=C1)/C=C/2\CN(CCC2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C30H29N3O/c1-23-20-28(32(2)31-23)21-24-22-33(19-18-29(24)34)30(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17,20-21H,18-19,22H2,1-2H3/b24-21+