methyl 2-[(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]oxypropanoate

Systemtic Name: methyl 2-[(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]oxypropanoate Openeye Name: methyl 2-[(E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]oxypropanoate CAS Name: 2-[(E)-3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[(E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoyl]oxypropanoate Traditional Name: 2-[(E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acryloyl]oxypropionic acid methyl ester Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC(=O)C=CC1=CN(N=C1C2=CC3=CC=CC=C3O2)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OC)OC(=O)/C=C/C1=CN(N=C1C2=CC3=CC=CC=C3O2)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O5/c1-16(24(28)29-2)30-22(27)13-12-18-15-26(19-9-4-3-5-10-19)25-23(18)21-14-17-8-6-7-11-20(17)31-21/h3-16H,1-2H3/b13-12+