methyl 4-[4-ethyl-5-fluoranyl-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]butanoate

Systemtic Name: methyl 4-[4-ethyl-5-fluoranyl-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]butanoate Openeye Name: methyl 4-[4-ethyl-5-fluoro-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]butanoate CAS Name: 4-[4-ethyl-5-fluoro-1-[4-(1-imidazolyl)phenyl]-3-methyl-2-indolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-ethyl-5-fluoro-1-(4-imidazol-1-ylphenyl)-3-methylindol-2-yl]butanoate Traditional Name: 4-[4-ethyl-5-fluoro-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]butyric acid methyl ester Formula: C25H26FN3O2 MolecularWeight: 419.491243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1C(=C(N2C3=CC=C(C=C3)N4C=CN=C4)CCCC(=O)OC)C)F

Isomeric SMILES

CCC1=C(C=CC2=C1C(=C(N2C3=CC=C(C=C3)N4C=CN=C4)CCCC(=O)OC)C)F

InChI

InChI=1S/C25H26FN3O2/c1-4-20-21(26)12-13-23-25(20)17(2)22(6-5-7-24(30)31-3)29(23)19-10-8-18(9-11-19)28-15-14-27-16-28/h8-16H,4-7H2,1-3H3