2-[8-chloranyl-1-(furan-3-yl)-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid

Systemtic Name: 2-[8-chloranyl-1-(furan-3-yl)-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[8-chloro-1-(3-furyl)-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[8-chloro-1-(3-furanyl)-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[8-chloro-1-(furan-3-yl)-5-(trifluoromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[8-chloro-1-(3-furyl)-5-(trifluoromethyl)-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C18H13ClF3NO4 MolecularWeight: 399.74833

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=C1C3=C(C=CC(=C3N2)Cl)C(F)(F)F)(CC(=O)O)C4=COC=C4

Isomeric SMILES

C1COC(C2=C1C3=C(C=CC(=C3N2)Cl)C(F)(F)F)(CC(=O)O)C4=COC=C4

InChI

InChI=1S/C18H13ClF3NO4/c19-12-2-1-11(18(20,21)22)14-10-4-6-27-17(7-13(24)25,9-3-5-26-8-9)16(10)23-15(12)14/h1-3,5,8,23H,4,6-7H2,(H,24,25)