1-[3-[(4-fluorophenyl)methyl]-4-oxidanyl-phenoxy]-3,4,6-trimethyl-indole-2-carboxylic acid

Systemtic Name: 1-[3-[(4-fluorophenyl)methyl]-4-oxidanyl-phenoxy]-3,4,6-trimethyl-indole-2-carboxylic acid Openeye Name: 1-[3-[(4-fluorophenyl)methyl]-4-hydroxy-phenoxy]-3,4,6-trimethyl-indole-2-carboxylic acid CAS Name: 1-[3-[(4-fluorophenyl)methyl]-4-hydroxyphenoxy]-3,4,6-trimethyl-2-indolecarboxylic acid IUPAC Name: 1-[3-[(4-fluorophenyl)methyl]-4-hydroxyphenoxy]-3,4,6-trimethylindole-2-carboxylic acid Traditional Name: 1-[3-(4-fluorobenzyl)-4-hydroxy-phenoxy]-3,4,6-trimethyl-indole-2-carboxylic acid Formula: C25H22FNO4 MolecularWeight: 419.444883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C(N(C2=C1)OC3=CC(=C(C=C3)O)CC4=CC=C(C=C4)F)C(=O)O)C)C

Isomeric SMILES

CC1=CC(=C2C(=C(N(C2=C1)OC3=CC(=C(C=C3)O)CC4=CC=C(C=C4)F)C(=O)O)C)C

InChI

InChI=1S/C25H22FNO4/c1-14-10-15(2)23-16(3)24(25(29)30)27(21(23)11-14)31-20-8-9-22(28)18(13-20)12-17-4-6-19(26)7-5-17/h4-11,13,28H,12H2,1-3H3,(H,29,30)