(1S)-N-[[(2R)-7-fluoranyl-5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: (1S)-N-[[(2R)-7-fluoranyl-5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide Openeye Name: (1S)-N-[[(2R)-7-fluoro-5-(3-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide CAS Name: (1S)-N-[[(2R)-7-fluoro-5-(3-pyridinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1S)-N-[[(2R)-7-fluoro-5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide Traditional Name: (1S)-N-[[(2R)-7-fluoro-5-(3-pyridyl)coumaran-2-yl]methyl]cyclohex-3-ene-1-carboxamide Formula: C21H21FN2O2 MolecularWeight: 352.402043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)C4=CN=CC=C4)F

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)NC[C@H]2CC3=C(O2)C(=CC(=C3)C4=CN=CC=C4)F

InChI

InChI=1S/C21H21FN2O2/c22-19-11-16(15-7-4-8-23-12-15)9-17-10-18(26-20(17)19)13-24-21(25)14-5-2-1-3-6-14/h1-2,4,7-9,11-12,14,18H,3,5-6,10,13H2,(H,24,25)/t14-,18-/m1/s1