ethyl 2-fluoranyl-4-oxidanyl-4-(5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)butanoate

Systemtic Name: ethyl 2-fluoranyl-4-oxidanyl-4-(5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)butanoate Openeye Name: ethyl 4-(5-benzyloxy-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-fluoro-4-hydroxy-butanoate CAS Name: 2-fluoro-4-hydroxy-4-(5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)butanoic acid ethyl ester IUPAC Name: ethyl 2-fluoro-4-hydroxy-4-(5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)butanoate Traditional Name: 4-(5-benzoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-fluoro-4-hydroxy-butyric acid ethyl ester Formula: C20H21FN2O4 MolecularWeight: 372.390143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C1=CNC2=CN=C(C=C12)OCC3=CC=CC=C3)O)F

Isomeric SMILES

CCOC(=O)C(CC(C1=CNC2=CN=C(C=C12)OCC3=CC=CC=C3)O)F

InChI

InChI=1S/C20H21FN2O4/c1-2-26-20(25)16(21)9-18(24)15-10-22-17-11-23-19(8-14(15)17)27-12-13-6-4-3-5-7-13/h3-8,10-11,16,18,22,24H,2,9,12H2,1H3