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

Systemtic Name: 4-[5-fluoranyl-1-[(4-imidazol-1-ylphenyl)methyl]-3-methyl-indol-2-yl]butanoic acid Openeye Name: 4-[5-fluoro-1-[(4-imidazol-1-ylphenyl)methyl]-3-methyl-indol-2-yl]butanoic acid CAS Name: 4-[5-fluoro-1-[[4-(1-imidazolyl)phenyl]methyl]-3-methyl-2-indolyl]butanoic acid IUPAC Name: 4-[5-fluoro-1-[(4-imidazol-1-ylphenyl)methyl]-3-methylindol-2-yl]butanoic acid Traditional Name: 4-[5-fluoro-1-(4-imidazol-1-ylbenzyl)-3-methyl-indol-2-yl]butyric acid Formula: C23H22FN3O2 MolecularWeight: 391.438083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=C(C=C3)N4C=CN=C4)CCCC(=O)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=C(C=C3)N4C=CN=C4)CCCC(=O)O

InChI

InChI=1S/C23H22FN3O2/c1-16-20-13-18(24)7-10-22(20)27(21(16)3-2-4-23(28)29)14-17-5-8-19(9-6-17)26-12-11-25-15-26/h5-13,15H,2-4,14H2,1H3,(H,28,29)