1-adamantyl-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-(2-pyridin-4-ylethyl)-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-[2-(4-pyridyl)ethyl]piperazino]methanone Formula: C22H31N3O MolecularWeight: 353.50104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=NC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1CCC2=CC=NC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H31N3O/c26-21(22-14-18-11-19(15-22)13-20(12-18)16-22)25-9-7-24(8-10-25)6-3-17-1-4-23-5-2-17/h1-2,4-5,18-20H,3,6-16H2