2-[5-bromanyl-6,8-bis(fluoranyl)-1-(furan-3-yl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-bromanyl-6,8-bis(fluoranyl)-1-(furan-3-yl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[5-bromo-6,8-difluoro-1-(3-furyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[5-bromo-6,8-difluoro-1-(3-furanyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[5-bromo-6,8-difluoro-1-(furan-3-yl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[5-bromo-6,8-difluoro-1-(3-furyl)-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C17H12BrF2NO4 MolecularWeight: 412.182286

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=C1C3=C(N2)C(=CC(=C3Br)F)F)(CC(=O)O)C4=COC=C4

Isomeric SMILES

C1COC(C2=C1C3=C(N2)C(=CC(=C3Br)F)F)(CC(=O)O)C4=COC=C4

InChI

InChI=1S/C17H12BrF2NO4/c18-14-10(19)5-11(20)15-13(14)9-2-4-25-17(6-12(22)23,16(9)21-15)8-1-3-24-7-8/h1,3,5,7,21H,2,4,6H2,(H,22,23)