3-[3-(1H-indazol-5-yl)-4-(2-methylpropoxy)phenyl]propanoic acid

Systemtic Name: 3-[3-(1H-indazol-5-yl)-4-(2-methylpropoxy)phenyl]propanoic acid Openeye Name: 3-[3-(1H-indazol-5-yl)-4-isobutoxy-phenyl]propanoic acid CAS Name: 3-[3-(1H-indazol-5-yl)-4-(2-methylpropoxy)phenyl]propanoic acid IUPAC Name: 3-[3-(1H-indazol-5-yl)-4-(2-methylpropoxy)phenyl]propanoic acid Traditional Name: 3-[3-(1H-indazol-5-yl)-4-isobutoxy-phenyl]propionic acid Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)CCC(=O)O)C2=CC3=C(C=C2)NN=C3

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)CCC(=O)O)C2=CC3=C(C=C2)NN=C3

InChI

InChI=1S/C20H22N2O3/c1-13(2)12-25-19-7-3-14(4-8-20(23)24)9-17(19)15-5-6-18-16(10-15)11-21-22-18/h3,5-7,9-11,13H,4,8,12H2,1-2H3,(H,21,22)(H,23,24)