7-[2,3-bis(chloranyl)phenyl]-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)hept-6-yn-1-one

Systemtic Name: 7-[2,3-bis(chloranyl)phenyl]-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)hept-6-yn-1-one Openeye Name: 7-(2,3-dichlorophenyl)-1-[5-(2-pyridyl)oxazol-2-yl]hept-6-yn-1-one CAS Name: 7-(2,3-dichlorophenyl)-1-[5-(2-pyridinyl)-2-oxazolyl]-6-heptyn-1-one IUPAC Name: 7-(2,3-dichlorophenyl)-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)hept-6-yn-1-one Traditional Name: 7-(2,3-dichlorophenyl)-1-[5-(2-pyridyl)oxazol-2-yl]hept-6-yn-1-one Formula: C21H16Cl2N2O2 MolecularWeight: 399.26994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CN=C(O2)C(=O)CCCCC#CC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1=CC=NC(=C1)C2=CN=C(O2)C(=O)CCCCC#CC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C21H16Cl2N2O2/c22-16-10-7-9-15(20(16)23)8-3-1-2-4-12-18(26)21-25-14-19(27-21)17-11-5-6-13-24-17/h5-7,9-11,13-14H,1-2,4,12H2