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

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

Systemtic Name:ethyl 2-[4-[bis(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]phenoxy]ethanoate
Openeye Name:ethyl 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 ethyl ester
IUPAC Name:ethyl 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 ethyl ester
Formula: C19H22N4O5
MolecularWeight: 386.40178
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C(C2=C(NNC2=O)C)C3=C(NNC3=O)C


Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)C(C2=C(NNC2=O)C)C3=C(NNC3=O)C


InChI

InChI=1S/C19H22N4O5/c1-4-27-14(24)9-28-13-7-5-12(6-8-13)17(15-10(2)20-22-18(15)25)16-11(3)21-23-19(16)26/h5-8,17H,4,9H2,1-3H3,(H2,20,22,25)(H2,21,23,26)


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