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

Systemtic Name: 1-[3-[(4-fluorophenyl)methyl]-4-oxidanyl-phenoxy]-4,6-dimethyl-indole-2-carboxylic acid Openeye Name: 1-[3-[(4-fluorophenyl)methyl]-4-hydroxy-phenoxy]-4,6-dimethyl-indole-2-carboxylic acid CAS Name: 1-[3-[(4-fluorophenyl)methyl]-4-hydroxyphenoxy]-4,6-dimethyl-2-indolecarboxylic acid IUPAC Name: 1-[3-[(4-fluorophenyl)methyl]-4-hydroxyphenoxy]-4,6-dimethylindole-2-carboxylic acid Traditional Name: 1-[3-(4-fluorobenzyl)-4-hydroxy-phenoxy]-4,6-dimethyl-indole-2-carboxylic acid Formula: C24H20FNO4 MolecularWeight: 405.418303

Click to see the large picture

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

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

InChI

InChI=1S/C24H20FNO4/c1-14-9-15(2)20-13-22(24(28)29)26(21(20)10-14)30-19-7-8-23(27)17(12-19)11-16-3-5-18(25)6-4-16/h3-10,12-13,27H,11H2,1-2H3,(H,28,29)