methyl 3-[4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-yl]propanoate

Systemtic Name: methyl 3-[4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-yl]propanoate Openeye Name: methyl 3-[4-(3-methoxy-3-oxo-propyl)-3-methyl-5-oxo-1-phenyl-pyrazol-4-yl]propanoate CAS Name: 3-[4-(3-methoxy-3-oxopropyl)-3-methyl-5-oxo-1-phenyl-4-pyrazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(3-methoxy-3-oxopropyl)-3-methyl-5-oxo-1-phenylpyrazol-4-yl]propanoate Traditional Name: 3-[5-keto-4-(3-keto-3-methoxy-propyl)-3-methyl-1-phenyl-2-pyrazolin-4-yl]propionic acid methyl ester Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1(CCC(=O)OC)CCC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1(CCC(=O)OC)CCC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O5/c1-13-18(11-9-15(21)24-2,12-10-16(22)25-3)17(23)20(19-13)14-7-5-4-6-8-14/h4-8H,9-12H2,1-3H3