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

Systemtic Name: 2-[(1S)-5-cyano-8-fluoranyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[(1S)-5-cyano-8-fluoro-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[(1S)-5-cyano-8-fluoro-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[(1S)-5-cyano-8-fluoro-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[(1S)-5-cyano-8-fluoro-1-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C17H17FN2O3 MolecularWeight: 316.326883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@@]1(C2=C(CCO1)C3=C(C=CC(=C3N2)F)C#N)CC(=O)O

InChI

InChI=1S/C17H17FN2O3/c1-2-6-17(8-13(21)22)16-11(5-7-23-17)14-10(9-19)3-4-12(18)15(14)20-16/h3-4,20H,2,5-8H2,1H3,(H,21,22)/t17-/m0/s1