1-[4-[[4-(5-hex-1-ynylpyridin-3-yl)carbonylmorpholin-2-yl]methoxy]-2-methyl-phenyl]ethanone

Systemtic Name: 1-[4-[[4-(5-hex-1-ynylpyridin-3-yl)carbonylmorpholin-2-yl]methoxy]-2-methyl-phenyl]ethanone Openeye Name: 1-[4-[[4-(5-hex-1-ynylpyridine-3-carbonyl)morpholin-2-yl]methoxy]-2-methyl-phenyl]ethanone CAS Name: 1-[4-[[4-[(5-hex-1-ynyl-3-pyridinyl)-oxomethyl]-2-morpholinyl]methoxy]-2-methylphenyl]ethanone IUPAC Name: 1-[4-[[4-(5-hex-1-ynylpyridine-3-carbonyl)morpholin-2-yl]methoxy]-2-methylphenyl]ethanone Traditional Name: 1-[4-[[4-(5-hex-1-ynylnicotinoyl)morpholin-2-yl]methoxy]-2-methyl-phenyl]ethanone Formula: C26H30N2O4 MolecularWeight: 434.5274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=CN=C1)C(=O)N2CCOC(C2)COC3=CC(=C(C=C3)C(=O)C)C

Isomeric SMILES

CCCCC#CC1=CC(=CN=C1)C(=O)N2CCOC(C2)COC3=CC(=C(C=C3)C(=O)C)C

InChI

InChI=1S/C26H30N2O4/c1-4-5-6-7-8-21-14-22(16-27-15-21)26(30)28-11-12-31-24(17-28)18-32-23-9-10-25(20(3)29)19(2)13-23/h9-10,13-16,24H,4-6,11-12,17-18H2,1-3H3