2-(3,4-dimethoxyphenyl)-2-[4-oxidanylidene-2-piperidin-1-yl-4-(2,4,6-trimethylphenyl)butyl]tetradecanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-[4-oxidanylidene-2-piperidin-1-yl-4-(2,4,6-trimethylphenyl)butyl]tetradecanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-[4-oxo-2-(1-piperidyl)-4-(2,4,6-trimethylphenyl)butyl]tetradecanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-2-[4-oxo-2-(1-piperidinyl)-4-(2,4,6-trimethylphenyl)butyl]tetradecanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-[4-oxo-2-piperidin-1-yl-4-(2,4,6-trimethylphenyl)butyl]tetradecanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-(4-keto-4-mesityl-2-piperidino-butyl)myristonitrile Formula: C40H60N2O3 MolecularWeight: 616.916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC(CC(=O)C1=C(C=C(C=C1C)C)C)N2CCCCC2)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCCCCCCCCCC(CC(CC(=O)C1=C(C=C(C=C1C)C)C)N2CCCCC2)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C40H60N2O3/c1-7-8-9-10-11-12-13-14-15-17-22-40(30-41,34-20-21-37(44-5)38(27-34)45-6)29-35(42-23-18-16-19-24-42)28-36(43)39-32(3)25-31(2)26-33(39)4/h20-21,25-27,35H,7-19,22-24,28-29H2,1-6H3