N-[2-tert-butyl-5-(cyanomethyl)phenyl]-3-(2,4-dimethoxyphenyl)octanamide

Systemtic Name: N-[2-tert-butyl-5-(cyanomethyl)phenyl]-3-(2,4-dimethoxyphenyl)octanamide Openeye Name: N-[2-tert-butyl-5-(cyanomethyl)phenyl]-3-(2,4-dimethoxyphenyl)octanamide CAS Name: N-[2-tert-butyl-5-(cyanomethyl)phenyl]-3-(2,4-dimethoxyphenyl)octanamide IUPAC Name: N-[2-tert-butyl-5-(cyanomethyl)phenyl]-3-(2,4-dimethoxyphenyl)octanamide Traditional Name: N-[2-tert-butyl-5-(cyanomethyl)phenyl]-3-(2,4-dimethoxyphenyl)caprylamide Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CC#N)C(C)(C)C)C2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CC#N)C(C)(C)C)C2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C28H38N2O3/c1-7-8-9-10-21(23-13-12-22(32-5)19-26(23)33-6)18-27(31)30-25-17-20(15-16-29)11-14-24(25)28(2,3)4/h11-14,17,19,21H,7-10,15,18H2,1-6H3,(H,30,31)