2-[2-methoxy-4-[(E)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-methoxy-4-[(E)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enoyl]phenoxy]ethanoic acid Openeye Name: 2-[2-methoxy-4-[(E)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]prop-2-enoyl]phenoxy]acetic acid CAS Name: 2-[2-methoxy-4-[(E)-1-oxo-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)prop-2-enyl]phenoxy]acetic acid IUPAC Name: 2-[2-methoxy-4-[(E)-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)prop-2-enoyl]phenoxy]acetic acid Traditional Name: 2-[2-methoxy-4-[(E)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acryloyl]phenoxy]acetic acid Formula: C26H21N3O5 MolecularWeight: 455.46204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C=CC2=CN(N=C2C3=CC=NC=C3)C4=CC=CC=C4)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)/C=C/C2=CN(N=C2C3=CC=NC=C3)C4=CC=CC=C4)OCC(=O)O

InChI

InChI=1S/C26H21N3O5/c1-33-24-15-19(8-10-23(24)34-17-25(31)32)22(30)9-7-20-16-29(21-5-3-2-4-6-21)28-26(20)18-11-13-27-14-12-18/h2-16H,17H2,1H3,(H,31,32)/b9-7+