methyl 3-[5,7-bis(fluoranyl)-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]propanoate

Systemtic Name: methyl 3-[5,7-bis(fluoranyl)-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]propanoate Openeye Name: methyl 3-[5,7-difluoro-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]propanoate CAS Name: 3-[5,7-difluoro-1-[4-(1-imidazolyl)phenyl]-3-methyl-2-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5,7-difluoro-1-(4-imidazol-1-ylphenyl)-3-methylindol-2-yl]propanoate Traditional Name: 3-[5,7-difluoro-1-(4-imidazol-1-ylphenyl)-3-methyl-indol-2-yl]propionic acid methyl ester Formula: C22H19F2N3O2 MolecularWeight: 395.401966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C(C=C(C=C12)F)F)C3=CC=C(C=C3)N4C=CN=C4)CCC(=O)OC

Isomeric SMILES

CC1=C(N(C2=C(C=C(C=C12)F)F)C3=CC=C(C=C3)N4C=CN=C4)CCC(=O)OC

InChI

InChI=1S/C22H19F2N3O2/c1-14-18-11-15(23)12-19(24)22(18)27(20(14)7-8-21(28)29-2)17-5-3-16(4-6-17)26-10-9-25-13-26/h3-6,9-13H,7-8H2,1-2H3