[2-[2-cyanoethyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-1-[(2,4-dichlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate

Systemtic Name: [2-[2-cyanoethyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-1-[(2,4-dichlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate Openeye Name: [2-[2-cyanoethyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxo-ethyl] 5-chloro-1-[(2,4-dichlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-[(2,4-dichlorophenyl)methyl]-3-methyl-4-pyrazolecarboxylic acid [2-[2-cyanoethyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl] 5-chloro-1-[(2,4-dichlorophenyl)methyl]-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(2,4-dichlorobenzyl)-3-methyl-pyrazole-4-carboxylic acid [2-[2-cyanoethyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-keto-ethyl] ester Formula: C25H21Cl3N4O5 MolecularWeight: 563.81704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC(=O)N(CCC#N)C2=CC3=C(C=C2)OCCO3)Cl)CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC(=O)N(CCC#N)C2=CC3=C(C=C2)OCCO3)Cl)CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H21Cl3N4O5/c1-15-23(24(28)32(30-15)13-16-3-4-17(26)11-19(16)27)25(34)37-14-22(33)31(8-2-7-29)18-5-6-20-21(12-18)36-10-9-35-20/h3-6,11-12H,2,8-10,13-14H2,1H3