N-[5-(aminomethyl)-2-tert-butyl-phenyl]-3-(2,6-dimethoxyphenyl)octanamide

Systemtic Name: N-[5-(aminomethyl)-2-tert-butyl-phenyl]-3-(2,6-dimethoxyphenyl)octanamide Openeye Name: N-[5-(aminomethyl)-2-tert-butyl-phenyl]-3-(2,6-dimethoxyphenyl)octanamide CAS Name: N-[5-(aminomethyl)-2-tert-butylphenyl]-3-(2,6-dimethoxyphenyl)octanamide IUPAC Name: N-[5-(aminomethyl)-2-tert-butylphenyl]-3-(2,6-dimethoxyphenyl)octanamide Traditional Name: N-[5-(aminomethyl)-2-tert-butyl-phenyl]-3-(2,6-dimethoxyphenyl)caprylamide Formula: C27H40N2O3 MolecularWeight: 440.6181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CN)C(C)(C)C)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CN)C(C)(C)C)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C27H40N2O3/c1-7-8-9-11-20(26-23(31-5)12-10-13-24(26)32-6)17-25(30)29-22-16-19(18-28)14-15-21(22)27(2,3)4/h10,12-16,20H,7-9,11,17-18,28H2,1-6H3,(H,29,30)