2-(1-adamantyl)-1-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(1-adamantyl)-1-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(1-adamantyl)-1-[4-(4-pyridylmethyl)-1,4-diazepan-1-yl]ethanone CAS Name: 2-(1-adamantyl)-1-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(1-adamantyl)-1-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2-(1-adamantyl)-1-[4-(4-pyridylmethyl)-1,4-diazepan-1-yl]ethanone Formula: C23H33N3O MolecularWeight: 367.52762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CC23CC4CC(C2)CC(C4)C3)CC5=CC=NC=C5

Isomeric SMILES

C1CN(CCN(C1)C(=O)CC23CC4CC(C2)CC(C4)C3)CC5=CC=NC=C5

InChI

InChI=1S/C23H33N3O/c27-22(16-23-13-19-10-20(14-23)12-21(11-19)15-23)26-7-1-6-25(8-9-26)17-18-2-4-24-5-3-18/h2-5,19-21H,1,6-17H2