6-chloranyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzoxazole

Systemtic Name: 6-chloranyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzoxazole Openeye Name: 6-chloro-2-[4-(2-pyridyl)but-3-ynyl]-1,3-benzoxazole CAS Name: 6-chloro-2-[4-(2-pyridinyl)but-3-ynyl]-1,3-benzoxazole IUPAC Name: 6-chloro-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzoxazole Traditional Name: 6-chloro-2-[4-(2-pyridyl)but-3-ynyl]-1,3-benzoxazole Formula: C16H11ClN2O MolecularWeight: 282.72434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CCCC2=NC3=C(O2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC=NC(=C1)C#CCCC2=NC3=C(O2)C=C(C=C3)Cl

InChI

InChI=1S/C16H11ClN2O/c17-12-8-9-14-15(11-12)20-16(19-14)7-2-1-5-13-6-3-4-10-18-13/h3-4,6,8-11H,2,7H2