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

Systemtic Name: methyl 2-[(E)-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]oxypropanoate Openeye Name: methyl 2-[(E)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-enoyl]oxypropanoate CAS Name: 2-[(E)-3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[(E)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enoyl]oxypropanoate Traditional Name: 2-[(E)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]acryloyl]oxypropionic acid methyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)OC(C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=C/C(=O)OC(C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H22N2O4/c1-16-9-11-18(12-10-16)22-19(13-14-21(26)29-17(2)23(27)28-3)15-25(24-22)20-7-5-4-6-8-20/h4-15,17H,1-3H3/b14-13+