7-[3-bromanyl-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]-3-(furan-2-yl)heptan-2-one

Systemtic Name: 7-[3-bromanyl-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]-3-(furan-2-yl)heptan-2-one Openeye Name: 7-[3-bromo-4-(4,5-dihydrooxazol-2-yl)phenoxy]-3-(2-furyl)heptan-2-one CAS Name: 7-[3-bromo-4-(4,5-dihydrooxazol-2-yl)phenoxy]-3-(2-furanyl)-2-heptanone IUPAC Name: 7-[3-bromo-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]-3-(furan-2-yl)heptan-2-one Traditional Name: 7-[3-bromo-4-(2-oxazolin-2-yl)phenoxy]-3-(2-furyl)heptan-2-one Formula: C20H22BrNO4 MolecularWeight: 420.29698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCOC1=CC(=C(C=C1)C2=NCCO2)Br)C3=CC=CO3

Isomeric SMILES

CC(=O)C(CCCCOC1=CC(=C(C=C1)C2=NCCO2)Br)C3=CC=CO3

InChI

InChI=1S/C20H22BrNO4/c1-14(23)16(19-6-4-11-25-19)5-2-3-10-24-15-7-8-17(18(21)13-15)20-22-9-12-26-20/h4,6-8,11,13,16H,2-3,5,9-10,12H2,1H3