5-(2-methylpropoxy)-1-pyridin-3-yl-1,4-diazepane

Systemtic Name: 5-(2-methylpropoxy)-1-pyridin-3-yl-1,4-diazepane Openeye Name: 5-isobutoxy-1-(3-pyridyl)-1,4-diazepane CAS Name: 5-(2-methylpropoxy)-1-(3-pyridinyl)-1,4-diazepane IUPAC Name: 5-(2-methylpropoxy)-1-pyridin-3-yl-1,4-diazepane Traditional Name: 5-isobutoxy-1-(3-pyridyl)-1,4-diazepane Formula: C14H23N3O MolecularWeight: 249.35192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1CCN(CCN1)C2=CN=CC=C2

Isomeric SMILES

CC(C)COC1CCN(CCN1)C2=CN=CC=C2

InChI

InChI=1S/C14H23N3O/c1-12(2)11-18-14-5-8-17(9-7-16-14)13-4-3-6-15-10-13/h3-4,6,10,12,14,16H,5,7-9,11H2,1-2H3