1-(5-but-3-en-2-yloxypyridin-3-yl)-1,4-diazepane

Systemtic Name: 1-(5-but-3-en-2-yloxypyridin-3-yl)-1,4-diazepane Openeye Name: 1-[5-(1-methylallyloxy)-3-pyridyl]-1,4-diazepane CAS Name: 1-(5-but-3-en-2-yloxy-3-pyridinyl)-1,4-diazepane IUPAC Name: 1-(5-but-3-en-2-yloxypyridin-3-yl)-1,4-diazepane Traditional Name: 1-[5-(1-methylallyloxy)-3-pyridyl]-1,4-diazepane Formula: C14H21N3O MolecularWeight: 247.33604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)OC1=CN=CC(=C1)N2CCCNCC2

Isomeric SMILES

CC(C=C)OC1=CN=CC(=C1)N2CCCNCC2

InChI

InChI=1S/C14H21N3O/c1-3-12(2)18-14-9-13(10-16-11-14)17-7-4-5-15-6-8-17/h3,9-12,15H,1,4-8H2,2H3