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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)O)OC1=CC=CC(=C1)CCCN2C=C(C=N2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(C(=O)O)OC1=CC=CC(=C1)CCCN2C=C(C=N2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

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