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

Systemtic Name: 2-[1-propyl-5-[2-(trifluoromethyl)phenyl]-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[1-propyl-5-[2-(trifluoromethyl)phenyl]-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[1-propyl-5-[2-(trifluoromethyl)phenyl]-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[1-propyl-5-[2-(trifluoromethyl)phenyl]-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[1-propyl-5-[2-(trifluoromethyl)phenyl]-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C23H22F3NO3 MolecularWeight: 417.42089

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(CCO1)C3=C(C=CC=C3N2)C4=CC=CC=C4C(F)(F)F)CC(=O)O

Isomeric SMILES

CCCC1(C2=C(CCO1)C3=C(C=CC=C3N2)C4=CC=CC=C4C(F)(F)F)CC(=O)O

InChI

InChI=1S/C23H22F3NO3/c1-2-11-22(13-19(28)29)21-16(10-12-30-22)20-15(7-5-9-18(20)27-21)14-6-3-4-8-17(14)23(24,25)26/h3-9,27H,2,10-13H2,1H3,(H,28,29)