4-[2-[[1-(4-fluoranyl-3-methyl-phenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butanoic acid

Systemtic Name: 4-[2-[[1-(4-fluoranyl-3-methyl-phenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butanoic acid Openeye Name: 4-[2-[[1-(4-fluoro-3-methyl-phenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butanoic acid CAS Name: 4-[2-[[[1-(4-fluoro-3-methylphenyl)-3-methylbutyl]amino]-oxomethyl]-4-phenoxyphenyl]butanoic acid IUPAC Name: 4-[2-[[1-(4-fluoro-3-methylphenyl)-3-methylbutyl]carbamoyl]-4-phenoxyphenyl]butanoic acid Traditional Name: 4-[2-[[1-(4-fluoro-3-methyl-phenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butyric acid Formula: C29H32FNO4 MolecularWeight: 477.567083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CC(C)C)NC(=O)C2=C(C=CC(=C2)OC3=CC=CC=C3)CCCC(=O)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(CC(C)C)NC(=O)C2=C(C=CC(=C2)OC3=CC=CC=C3)CCCC(=O)O)F

InChI

InChI=1S/C29H32FNO4/c1-19(2)16-27(22-13-15-26(30)20(3)17-22)31-29(34)25-18-24(35-23-9-5-4-6-10-23)14-12-21(25)8-7-11-28(32)33/h4-6,9-10,12-15,17-19,27H,7-8,11,16H2,1-3H3,(H,31,34)(H,32,33)