5-[7-[2-bromanyl-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]heptyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[7-[2-bromanyl-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]heptyl]-3-methyl-1,2-oxazole Openeye Name: 5-[7-[2-bromo-4-(4,5-dihydrooxazol-2-yl)phenoxy]heptyl]-3-methyl-isoxazole CAS Name: 5-[7-[2-bromo-4-(4,5-dihydrooxazol-2-yl)phenoxy]heptyl]-3-methylisoxazole IUPAC Name: 5-[7-[2-bromo-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]heptyl]-3-methyl-1,2-oxazole Traditional Name: 5-[7-[2-bromo-4-(2-oxazolin-2-yl)phenoxy]heptyl]-3-methyl-isoxazole Formula: C20H25BrN2O3 MolecularWeight: 421.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CCCCCCCOC2=C(C=C(C=C2)C3=NCCO3)Br

Isomeric SMILES

CC1=NOC(=C1)CCCCCCCOC2=C(C=C(C=C2)C3=NCCO3)Br

InChI

InChI=1S/C20H25BrN2O3/c1-15-13-17(26-23-15)7-5-3-2-4-6-11-24-19-9-8-16(14-18(19)21)20-22-10-12-25-20/h8-9,13-14H,2-7,10-12H2,1H3