2-[4-(2-adamantyl)piperazin-1-yl]-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[4-(2-adamantyl)piperazin-1-yl]-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[4-(2-adamantyl)piperazin-1-yl]-N-(2-nitrophenyl)acetamide CAS Name: 2-[4-(2-adamantyl)-1-piperazinyl]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[4-(2-adamantyl)piperazin-1-yl]-N-(2-nitrophenyl)acetamide Traditional Name: 2-[4-(2-adamantyl)piperazino]-N-(2-nitrophenyl)acetamide Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H30N4O3/c27-21(23-19-3-1-2-4-20(19)26(28)29)14-24-5-7-25(8-6-24)22-17-10-15-9-16(12-17)13-18(22)11-15/h1-4,15-18,22H,5-14H2,(H,23,27)