3-(4-bromanyl-2-fluoranyl-phenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-phenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one Openeye Name: 3-(4-bromo-2-fluoro-phenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one CAS Name: 3-(4-bromo-2-fluorophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one IUPAC Name: 3-(4-bromo-2-fluorophenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one Traditional Name: 3-(4-bromo-2-fluoro-phenyl)-6-butyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one Formula: C22H21BrFNO3 MolecularWeight: 446.309443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=C(C=C(C=C4)Br)F)C=C12)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=C(C=C(C=C4)Br)F)C=C12)C

InChI

InChI=1S/C22H21BrFNO3/c1-3-4-5-14-9-20(26)28-22-13(2)21-15(8-17(14)22)11-25(12-27-21)19-7-6-16(23)10-18(19)24/h6-10H,3-5,11-12H2,1-2H3