N-(1-adamantyl)-2-[2-(5-cyano-1-cyclohexyl-6-oxidanylidene-pyridin-3-yl)carbonylphenoxy]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[2-(5-cyano-1-cyclohexyl-6-oxidanylidene-pyridin-3-yl)carbonylphenoxy]ethanamide Openeye Name: N-(1-adamantyl)-2-[2-(5-cyano-1-cyclohexyl-6-oxo-pyridine-3-carbonyl)phenoxy]acetamide CAS Name: N-(1-adamantyl)-2-[2-[(5-cyano-1-cyclohexyl-6-oxo-3-pyridinyl)-oxomethyl]phenoxy]acetamide IUPAC Name: N-(1-adamantyl)-2-[2-(5-cyano-1-cyclohexyl-6-oxopyridine-3-carbonyl)phenoxy]acetamide Traditional Name: N-(1-adamantyl)-2-[2-(5-cyano-1-cyclohexyl-6-keto-nicotinoyl)phenoxy]acetamide Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=C(C=C(C2=O)C#N)C(=O)C3=CC=CC=C3OCC(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCC(CC1)N2C=C(C=C(C2=O)C#N)C(=O)C3=CC=CC=C3OCC(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H35N3O4/c32-17-23-13-24(18-34(30(23)37)25-6-2-1-3-7-25)29(36)26-8-4-5-9-27(26)38-19-28(35)33-31-14-20-10-21(15-31)12-22(11-20)16-31/h4-5,8-9,13,18,20-22,25H,1-3,6-7,10-12,14-16,19H2,(H,33,35)