2-[5-fluoranyl-2-methyl-3-[[2-(4-methylphenoxy)phenyl]methyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2-methyl-3-[[2-(4-methylphenoxy)phenyl]methyl]indol-1-yl]ethanoic acid Openeye Name: 2-[5-fluoro-2-methyl-3-[[2-(4-methylphenoxy)phenyl]methyl]indol-1-yl]acetic acid CAS Name: 2-[5-fluoro-2-methyl-3-[[2-(4-methylphenoxy)phenyl]methyl]-1-indolyl]acetic acid IUPAC Name: 2-[5-fluoro-2-methyl-3-[[2-(4-methylphenoxy)phenyl]methyl]indol-1-yl]acetic acid Traditional Name: 2-[5-fluoro-2-methyl-3-[2-(4-methylphenoxy)benzyl]indol-1-yl]acetic acid Formula: C25H22FNO3 MolecularWeight: 403.445483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC=C2CC3=C(N(C4=C3C=C(C=C4)F)CC(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC=C2CC3=C(N(C4=C3C=C(C=C4)F)CC(=O)O)C

InChI

InChI=1S/C25H22FNO3/c1-16-7-10-20(11-8-16)30-24-6-4-3-5-18(24)13-21-17(2)27(15-25(28)29)23-12-9-19(26)14-22(21)23/h3-12,14H,13,15H2,1-2H3,(H,28,29)