methyl 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]ethanoate Openeye Name: methyl 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]acetate CAS Name: 2-[3-[2-(4,5-diphenyl-1-pyrazolyl)ethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]acetate Traditional Name: 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]acetic acid methyl ester Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC(=C1)CCN2C(=C(C=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)COC1=CC=CC(=C1)CCN2C(=C(C=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O3/c1-30-25(29)19-31-23-14-8-9-20(17-23)15-16-28-26(22-12-6-3-7-13-22)24(18-27-28)21-10-4-2-5-11-21/h2-14,17-18H,15-16,19H2,1H3