(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 3-(1,3,5-trimethylpyrazol-4-yl)propanoate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 3-(1,3,5-trimethylpyrazol-4-yl)propanoate CAS Name: 3-(1,3,5-trimethyl-4-pyrazolyl)propanoic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Traditional Name: 3-(1,3,5-trimethylpyrazol-4-yl)propionic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4/c1-12-15(13(2)20(3)19-12)10-11-16(21)24-17(18(22)23-4)14-8-6-5-7-9-14/h5-9,17H,10-11H2,1-4H3