2-[5-[3-[4-(diphenylmethyl)pyrazol-1-yl]propyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[5-[3-[4-(diphenylmethyl)pyrazol-1-yl]propyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[5-[3-(4-benzhydrylpyrazol-1-yl)propyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[5-[3-[4-(diphenylmethyl)-1-pyrazolyl]propyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[5-[3-(4-benzhydrylpyrazol-1-yl)propyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[5-[3-(4-benzhydrylpyrazol-1-yl)propyl]-2-methoxy-phenoxy]acetic acid Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCCN2C=C(C=N2)C(C3=CC=CC=C3)C4=CC=CC=C4)OCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CCCN2C=C(C=N2)C(C3=CC=CC=C3)C4=CC=CC=C4)OCC(=O)O

InChI

InChI=1S/C28H28N2O4/c1-33-25-15-14-21(17-26(25)34-20-27(31)32)9-8-16-30-19-24(18-29-30)28(22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-7,10-15,17-19,28H,8-9,16,20H2,1H3,(H,31,32)