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7-(2-phenylethynyl)-2-pyridin-2-yl-1,4-diazepane

7-(2-phenylethynyl)-2-pyridin-2-yl-1,4-diazepane

Systemtic Name:7-(2-phenylethynyl)-2-pyridin-2-yl-1,4-diazepane
Openeye Name:7-(2-phenylethynyl)-2-(2-pyridyl)-1,4-diazepane
CAS Name:7-(2-phenylethynyl)-2-(2-pyridinyl)-1,4-diazepane
IUPAC Name:7-(2-phenylethynyl)-2-pyridin-2-yl-1,4-diazepane
Traditional Name:7-(2-phenylethynyl)-2-(2-pyridyl)-1,4-diazepane
Formula: C18H19N3
MolecularWeight: 277.36356
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(NC1C#CC2=CC=CC=C2)C3=CC=CC=N3


Isomeric SMILES

C1CNCC(NC1C#CC2=CC=CC=C2)C3=CC=CC=N3


InChI

InChI=1S/C18H19N3/c1-2-6-15(7-3-1)9-10-16-11-13-19-14-18(21-16)17-8-4-5-12-20-17/h1-8,12,16,18-19,21H,11,13-14H2


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