3-[4-[5-(3-cyano-4-propan-2-yloxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]-3-methyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[5-(3-cyano-4-propan-2-yloxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]-3-methyl-phenyl]propanoic acid Openeye Name: 3-[4-[5-(3-cyano-4-isopropoxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]-3-methyl-phenyl]propanoic acid CAS Name: 3-[4-[5-(3-cyano-4-propan-2-yloxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-3-methylphenyl]propanoic acid IUPAC Name: 3-[4-[5-(3-cyano-4-propan-2-yloxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-3-methylphenyl]propanoic acid Traditional Name: 3-[4-[5-(3-cyano-4-isopropoxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]-3-methyl-phenyl]propionic acid Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCC(=O)O)C2=NN=C(N2C)C3=CC(=C(C=C3)OC(C)C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)CCC(=O)O)C2=NN=C(N2C)C3=CC(=C(C=C3)OC(C)C)C#N

InChI

InChI=1S/C23H24N4O3/c1-14(2)30-20-9-7-17(12-18(20)13-24)22-25-26-23(27(22)4)19-8-5-16(11-15(19)3)6-10-21(28)29/h5,7-9,11-12,14H,6,10H2,1-4H3,(H,28,29)