methyl 3-[4-[[4-[(5-methyl-3-phenyl-pyrazol-1-yl)methyl]phenyl]methoxy]phenyl]propanoate

Systemtic Name: methyl 3-[4-[[4-[(5-methyl-3-phenyl-pyrazol-1-yl)methyl]phenyl]methoxy]phenyl]propanoate Openeye Name: methyl 3-[4-[[4-[(5-methyl-3-phenyl-pyrazol-1-yl)methyl]phenyl]methoxy]phenyl]propanoate CAS Name: 3-[4-[[4-[(5-methyl-3-phenyl-1-pyrazolyl)methyl]phenyl]methoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[[4-[(5-methyl-3-phenylpyrazol-1-yl)methyl]phenyl]methoxy]phenyl]propanoate Traditional Name: 3-[4-[4-[(5-methyl-3-phenyl-pyrazol-1-yl)methyl]benzyl]oxyphenyl]propionic acid methyl ester Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)COC3=CC=C(C=C3)CCC(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)COC3=CC=C(C=C3)CCC(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3/c1-21-18-27(25-6-4-3-5-7-25)29-30(21)19-23-8-10-24(11-9-23)20-33-26-15-12-22(13-16-26)14-17-28(31)32-2/h3-13,15-16,18H,14,17,19-20H2,1-2H3