methyl 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]oxymethyl]benzoate

Systemtic Name: methyl 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]oxymethyl]benzoate Openeye Name: methyl 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]oxymethyl]benzoate CAS Name: 3-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]oxymethyl]benzoate Traditional Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]oxymethyl]benzoic acid methyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)OCC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)OCC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O4/c1-12-16(13(2)20(3)19-12)8-9-17(21)24-11-14-6-5-7-15(10-14)18(22)23-4/h5-10H,11H2,1-4H3/b9-8+