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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(C)C(=O)O)C2=CC3=C(C=C2)NN=C3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(C)C(=O)O)C2=CC3=C(C=C2)NN=C3

InChI

InChI=1S/C20H22N2O3/c1-3-4-9-25-19-8-6-14(13(2)20(23)24)11-17(19)15-5-7-18-16(10-15)12-21-22-18/h5-8,10-13H,3-4,9H2,1-2H3,(H,21,22)(H,23,24)