N'-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pentanediamide

Systemtic Name: N'-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pentanediamide Openeye Name: N'-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pentanediamide CAS Name: N'-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pentanediamide IUPAC Name: N'-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pentanediamide Traditional Name: N'-(1-adamantyl)-N-homoveratryl-glutaramide Formula: C25H36N2O4 MolecularWeight: 428.56434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCCC(=O)NC23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCCC(=O)NC23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C25H36N2O4/c1-30-21-7-6-17(13-22(21)31-2)8-9-26-23(28)4-3-5-24(29)27-25-14-18-10-19(15-25)12-20(11-18)16-25/h6-7,13,18-20H,3-5,8-12,14-16H2,1-2H3,(H,26,28)(H,27,29)