3-[4-(cyclohexylmethoxy)-3-(1-methylindazol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindazol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindazol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-(cyclohexylmethoxy)-3-(1-methyl-5-indazolyl)phenyl]propanoic acid IUPAC Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindazol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindazol-5-yl)phenyl]propionic acid Formula: C24H28N2O3 MolecularWeight: 392.49072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4CCCCC4)C=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4CCCCC4)C=N1

InChI

InChI=1S/C24H28N2O3/c1-26-22-10-9-19(14-20(22)15-25-26)21-13-17(8-12-24(27)28)7-11-23(21)29-16-18-5-3-2-4-6-18/h7,9-11,13-15,18H,2-6,8,12,16H2,1H3,(H,27,28)