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

Systemtic Name: N-[5-(bromomethyl)-2-tert-butyl-phenyl]-3-(2,3-dimethoxyphenyl)octanamide Openeye Name: N-[5-(bromomethyl)-2-tert-butyl-phenyl]-3-(2,3-dimethoxyphenyl)octanamide CAS Name: N-[5-(bromomethyl)-2-tert-butylphenyl]-3-(2,3-dimethoxyphenyl)octanamide IUPAC Name: N-[5-(bromomethyl)-2-tert-butylphenyl]-3-(2,3-dimethoxyphenyl)octanamide Traditional Name: N-[5-(bromomethyl)-2-tert-butyl-phenyl]-3-(2,3-dimethoxyphenyl)caprylamide Formula: C27H38BrNO3 MolecularWeight: 504.49952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CBr)C(C)(C)C)C2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CBr)C(C)(C)C)C2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C27H38BrNO3/c1-7-8-9-11-20(21-12-10-13-24(31-5)26(21)32-6)17-25(30)29-23-16-19(18-28)14-15-22(23)27(2,3)4/h10,12-16,20H,7-9,11,17-18H2,1-6H3,(H,29,30)