4-[7-[2-[4-[4-(3-chloranyl-2-methyl-phenyl)butoxy]phenyl]ethynyl]-4-fluoranyl-2-methyl-1-(4-oxidanyl-4-oxidanylidene-butyl)indol-3-yl]butanoic acid

Systemtic Name: 4-[7-[2-[4-[4-(3-chloranyl-2-methyl-phenyl)butoxy]phenyl]ethynyl]-4-fluoranyl-2-methyl-1-(4-oxidanyl-4-oxidanylidene-butyl)indol-3-yl]butanoic acid Openeye Name: 4-[7-[2-[4-[4-(3-chloro-2-methyl-phenyl)butoxy]phenyl]ethynyl]-4-fluoro-1-(4-hydroxy-4-oxo-butyl)-2-methyl-indol-3-yl]butanoic acid CAS Name: 4-[7-[2-[4-[4-(3-chloro-2-methylphenyl)butoxy]phenyl]ethynyl]-4-fluoro-1-(4-hydroxy-4-oxobutyl)-2-methyl-3-indolyl]butanoic acid IUPAC Name: 4-[7-[2-[4-[4-(3-chloro-2-methylphenyl)butoxy]phenyl]ethynyl]-4-fluoro-1-(4-hydroxy-4-oxobutyl)-2-methylindol-3-yl]butanoic acid Traditional Name: 4-[7-[2-[4-[4-(3-chloro-2-methyl-phenyl)butoxy]phenyl]ethynyl]-4-fluoro-1-(4-hydroxy-4-keto-butyl)-2-methyl-indol-3-yl]butyric acid Formula: C36H37ClFNO5 MolecularWeight: 618.134083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)CCCCOC2=CC=C(C=C2)C#CC3=C4C(=C(C=C3)F)C(=C(N4CCCC(=O)O)C)CCCC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)CCCCOC2=CC=C(C=C2)C#CC3=C4C(=C(C=C3)F)C(=C(N4CCCC(=O)O)C)CCCC(=O)O

InChI

InChI=1S/C36H37ClFNO5/c1-24-27(9-5-11-31(24)37)8-3-4-23-44-29-19-15-26(16-20-29)14-17-28-18-21-32(38)35-30(10-6-12-33(40)41)25(2)39(36(28)35)22-7-13-34(42)43/h5,9,11,15-16,18-21H,3-4,6-8,10,12-13,22-23H2,1-2H3,(H,40,41)(H,42,43)