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methyl 2-[4-[bis(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]phenoxy]ethanoate

methyl 2-[4-[bis(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]phenoxy]ethanoate

Systemtic Name:methyl 2-[4-[bis(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]phenoxy]ethanoate
Openeye Name:methyl 2-[4-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]phenoxy]acetate
CAS Name:2-[4-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]phenoxy]acetic acid methyl ester
IUPAC Name:methyl 2-[4-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]phenoxy]acetate
Traditional Name:2-[4-[bis(3-keto-5-methyl-3-pyrazolin-4-yl)methyl]phenoxy]acetic acid methyl ester
Formula: C18H20N4O5
MolecularWeight: 372.3752
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C(C2=CC=C(C=C2)OCC(=O)OC)C3=C(NNC3=O)C


Isomeric SMILES

CC1=C(C(=O)NN1)C(C2=CC=C(C=C2)OCC(=O)OC)C3=C(NNC3=O)C


InChI

InChI=1S/C18H20N4O5/c1-9-14(17(24)21-19-9)16(15-10(2)20-22-18(15)25)11-4-6-12(7-5-11)27-8-13(23)26-3/h4-7,16H,8H2,1-3H3,(H2,19,21,24)(H2,20,22,25)


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