3-[5-[[2-(4-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]indol-1-yl]propanoic acid

Systemtic Name: 3-[5-[[2-(4-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]indol-1-yl]propanoic acid Openeye Name: 3-[5-[[2-(4-bromophenyl)-5-methyl-oxazol-4-yl]methoxy]indol-1-yl]propanoic acid CAS Name: 3-[5-[[2-(4-bromophenyl)-5-methyl-4-oxazolyl]methoxy]-1-indolyl]propanoic acid IUPAC Name: 3-[5-[[2-(4-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]indol-1-yl]propanoic acid Traditional Name: 3-[5-[[2-(4-bromophenyl)-5-methyl-oxazol-4-yl]methoxy]indol-1-yl]propionic acid Formula: C22H19BrN2O4 MolecularWeight: 455.30126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)Br)COC3=CC4=C(C=C3)N(C=C4)CCC(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)Br)COC3=CC4=C(C=C3)N(C=C4)CCC(=O)O

InChI

InChI=1S/C22H19BrN2O4/c1-14-19(24-22(29-14)15-2-4-17(23)5-3-15)13-28-18-6-7-20-16(12-18)8-10-25(20)11-9-21(26)27/h2-8,10,12H,9,11,13H2,1H3,(H,26,27)