4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentanoic acid

Systemtic Name: 4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentanoic acid Openeye Name: 4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentanoic acid CAS Name: 4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentanoic acid IUPAC Name: 4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentanoic acid Traditional Name: 4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)valeric acid Formula: C21H23FN2O4 MolecularWeight: 386.416723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=CC2=C(N1)C=NC=C2)(C(=O)O)O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC(C)(CC(CC1=CC2=C(N1)C=NC=C2)(C(=O)O)O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C21H23FN2O4/c1-20(2,16-9-14(22)4-5-18(16)28-3)12-21(27,19(25)26)10-15-8-13-6-7-23-11-17(13)24-15/h4-9,11,24,27H,10,12H2,1-3H3,(H,25,26)