1-[(2,4-dimethylphenyl)methyl]-2-oxidanylidene-6-(4-piperidin-4-yloxyphenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 1-[(2,4-dimethylphenyl)methyl]-2-oxidanylidene-6-(4-piperidin-4-yloxyphenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 1-[(2,4-dimethylphenyl)methyl]-2-oxo-6-[4-(4-piperidyloxy)phenyl]-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 1-[(2,4-dimethylphenyl)methyl]-2-oxo-6-[4-(4-piperidinyloxy)phenyl]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 1-[(2,4-dimethylphenyl)methyl]-2-oxo-6-(4-piperidin-4-yloxyphenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 1-(2,4-dimethylbenzyl)-2-keto-6-[4-(4-piperidyloxy)phenyl]-4-(trifluoromethyl)nicotinonitrile Formula: C27H26F3N3O2 MolecularWeight: 481.50945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2C(=CC(=C(C2=O)C#N)C(F)(F)F)C3=CC=C(C=C3)OC4CCNCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN2C(=CC(=C(C2=O)C#N)C(F)(F)F)C3=CC=C(C=C3)OC4CCNCC4)C

InChI

InChI=1S/C27H26F3N3O2/c1-17-3-4-20(18(2)13-17)16-33-25(14-24(27(28,29)30)23(15-31)26(33)34)19-5-7-21(8-6-19)35-22-9-11-32-12-10-22/h3-8,13-14,22,32H,9-12,16H2,1-2H3