3-[3-(1-methylindazol-5-yl)-4-[2-(4-methylphenyl)ethoxy]phenyl]propanoic acid

Systemtic Name: 3-[3-(1-methylindazol-5-yl)-4-[2-(4-methylphenyl)ethoxy]phenyl]propanoic acid Openeye Name: 3-[3-(1-methylindazol-5-yl)-4-[2-(p-tolyl)ethoxy]phenyl]propanoic acid CAS Name: 3-[3-(1-methyl-5-indazolyl)-4-[2-(4-methylphenyl)ethoxy]phenyl]propanoic acid IUPAC Name: 3-[3-(1-methylindazol-5-yl)-4-[2-(4-methylphenyl)ethoxy]phenyl]propanoic acid Traditional Name: 3-[3-(1-methylindazol-5-yl)-4-[2-(p-tolyl)ethoxy]phenyl]propionic acid Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCOC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)N(N=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CCOC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)N(N=C4)C

InChI

InChI=1S/C26H26N2O3/c1-18-3-5-19(6-4-18)13-14-31-25-11-7-20(8-12-26(29)30)15-23(25)21-9-10-24-22(16-21)17-27-28(24)2/h3-7,9-11,15-17H,8,12-14H2,1-2H3,(H,29,30)