2-(1-adamantyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-(1-adamantyl)-N-[4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[4-(4-propanoylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[4-(4-propionylpiperazino)phenyl]acetamide Formula: C25H35N3O2 MolecularWeight: 409.5643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H35N3O2/c1-2-24(30)28-9-7-27(8-10-28)22-5-3-21(4-6-22)26-23(29)17-25-14-18-11-19(15-25)13-20(12-18)16-25/h3-6,18-20H,2,7-17H2,1H3,(H,26,29)