2-[(1S)-5-cyano-6-fluoranyl-8-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid

Systemtic Name: 2-[(1S)-5-cyano-6-fluoranyl-8-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[(1S)-5-cyano-6-fluoro-8-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[(1S)-5-cyano-6-fluoro-8-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[(1S)-5-cyano-6-fluoro-8-methyl-1-propyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[(1S)-5-cyano-6-fluoro-8-methyl-1-propyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C18H19FN2O3 MolecularWeight: 330.353463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(CCO1)C3=C(N2)C(=CC(=C3C#N)F)C)CC(=O)O

Isomeric SMILES

CCC[C@@]1(C2=C(CCO1)C3=C(N2)C(=CC(=C3C#N)F)C)CC(=O)O

InChI

InChI=1S/C18H19FN2O3/c1-3-5-18(8-14(22)23)17-11(4-6-24-18)15-12(9-20)13(19)7-10(2)16(15)21-17/h7,21H,3-6,8H2,1-2H3,(H,22,23)/t18-/m0/s1