1-but-1-ynyl-4-pyridin-3-yl-1,4-diazepane

Systemtic Name: 1-but-1-ynyl-4-pyridin-3-yl-1,4-diazepane Openeye Name: 1-but-1-ynyl-4-(3-pyridyl)-1,4-diazepane CAS Name: 1-but-1-ynyl-4-(3-pyridinyl)-1,4-diazepane IUPAC Name: 1-but-1-ynyl-4-pyridin-3-yl-1,4-diazepane Traditional Name: 1-but-1-ynyl-4-(3-pyridyl)-1,4-diazepane Formula: C14H19N3 MolecularWeight: 229.32076

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CN1CCCN(CC1)C2=CN=CC=C2

Isomeric SMILES

CCC#CN1CCCN(CC1)C2=CN=CC=C2

InChI

InChI=1S/C14H19N3/c1-2-3-8-16-9-5-10-17(12-11-16)14-6-4-7-15-13-14/h4,6-7,13H,2,5,9-12H2,1H3