2-(8-fluoranyl-5-phenyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid

Systemtic Name: 2-(8-fluoranyl-5-phenyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid Openeye Name: 2-(8-fluoro-5-phenyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid CAS Name: 2-(8-fluoro-5-phenyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid IUPAC Name: 2-(8-fluoro-5-phenyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid Traditional Name: 2-(8-fluoro-5-phenyl-1-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl)acetic acid Formula: C22H22FNO3 MolecularWeight: 367.413383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22FNO3/c1-2-11-22(13-18(25)26)21-16(10-12-27-22)19-15(14-6-4-3-5-7-14)8-9-17(23)20(19)24-21/h3-9,24H,2,10-13H2,1H3,(H,25,26)