2-[4-[(6-butyl-2-oxidanylidene-3-pyrrolidin-1-yl-pyridin-1-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(6-butyl-2-oxidanylidene-3-pyrrolidin-1-yl-pyridin-1-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(6-butyl-2-oxo-3-pyrrolidin-1-yl-1-pyridyl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[[6-butyl-2-oxo-3-(1-pyrrolidinyl)-1-pyridinyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(6-butyl-2-oxo-3-pyrrolidin-1-ylpyridin-1-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(6-butyl-2-keto-3-pyrrolidino-1-pyridyl)methyl]phenyl]benzonitrile Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)N4CCCC4

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)N4CCCC4

InChI

InChI=1S/C27H29N3O/c1-2-3-9-24-15-16-26(29-17-6-7-18-29)27(31)30(24)20-21-11-13-22(14-12-21)25-10-5-4-8-23(25)19-28/h4-5,8,10-16H,2-3,6-7,9,17-18,20H2,1H3