2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-phenylpiperidin-1-yl)pyridin-3-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-phenylpiperidin-1-yl)pyridin-3-yl]methylidene]propanedinitrile Openeye Name: 2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-phenyl-1-piperidyl)-3-pyridyl]methylene]propanedinitrile CAS Name: 2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-phenyl-1-piperidinyl)-3-pyridinyl]methylidene]propanedinitrile IUPAC Name: 2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-phenylpiperidin-1-yl)pyridin-3-yl]methylidene]propanedinitrile Traditional Name: 2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-phenylpiperidino)-3-pyridyl]methylene]malononitrile Formula: C29H25N5O MolecularWeight: 459.5417

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=C(C(=C1C#N)C2=CC=CC=C2)C=C(C#N)C#N)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=NC(=C(C(=C1C#N)C2=CC=CC=C2)C=C(C#N)C#N)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C29H25N5O/c1-2-35-29-26(20-32)27(24-11-7-4-8-12-24)25(17-21(18-30)19-31)28(33-29)34-15-13-23(14-16-34)22-9-5-3-6-10-22/h3-12,17,23H,2,13-16H2,1H3