2-[1-(3,3-diphenylpropanoyl)piperidin-4-ylidene]-2-pyridin-3-yl-ethanenitrile

Systemtic Name: 2-[1-(3,3-diphenylpropanoyl)piperidin-4-ylidene]-2-pyridin-3-yl-ethanenitrile Openeye Name: 2-[1-(3,3-diphenylpropanoyl)-4-piperidylidene]-2-(3-pyridyl)acetonitrile CAS Name: 2-[1-(1-oxo-3,3-diphenylpropyl)-4-piperidinylidene]-2-(3-pyridinyl)acetonitrile IUPAC Name: 2-[1-(3,3-diphenylpropanoyl)piperidin-4-ylidene]-2-pyridin-3-ylacetonitrile Traditional Name: 2-[1-(3,3-diphenylpropanoyl)-4-piperidylidene]-2-(3-pyridyl)acetonitrile Formula: C27H25N3O MolecularWeight: 407.5069

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=C(C#N)C2=CN=CC=C2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1=C(C#N)C2=CN=CC=C2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O/c28-19-26(24-12-7-15-29-20-24)23-13-16-30(17-14-23)27(31)18-25(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-12,15,20,25H,13-14,16-18H2