4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-2-[3-(phenylcarbonyl)phenoxy]benzenecarbonitrile

Systemtic Name: 4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]-2-[3-(phenylcarbonyl)phenoxy]benzenecarbonitrile Openeye Name: 2-(3-benzoylphenoxy)-4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile CAS Name: 2-(3-benzoylphenoxy)-4-[1-(3-methyl-4-imidazolyl)-2-pyrrolidinyl]benzonitrile IUPAC Name: 2-(3-benzoylphenoxy)-4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Traditional Name: 2-(3-benzoylphenoxy)-4-[1-(3-methylimidazol-4-yl)pyrrolidin-2-yl]benzonitrile Formula: C28H24N4O2 MolecularWeight: 448.51576

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1N2CCCC2C3=CC(=C(C=C3)C#N)OC4=CC=CC(=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C=NC=C1N2CCCC2C3=CC(=C(C=C3)C#N)OC4=CC=CC(=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O2/c1-31-19-30-18-27(31)32-14-6-11-25(32)21-12-13-23(17-29)26(16-21)34-24-10-5-9-22(15-24)28(33)20-7-3-2-4-8-20/h2-5,7-10,12-13,15-16,18-19,25H,6,11,14H2,1H3