3-methylbut-2-enyl 5-azanyl-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: 3-methylbut-2-enyl 5-azanyl-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-4-carboxylate Openeye Name: 3-methylbut-2-enyl 5-amino-1-(2,4,6-trichlorophenyl)pyrazole-4-carboxylate CAS Name: 5-amino-1-(2,4,6-trichlorophenyl)-4-pyrazolecarboxylic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl 5-amino-1-(2,4,6-trichlorophenyl)pyrazole-4-carboxylate Traditional Name: 5-amino-1-(2,4,6-trichlorophenyl)pyrazole-4-carboxylic acid 3-methylbut-2-enyl ester Formula: C15H14Cl3N3O2 MolecularWeight: 374.64956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2Cl)Cl)Cl)N)C

Isomeric SMILES

CC(=CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2Cl)Cl)Cl)N)C

InChI

InChI=1S/C15H14Cl3N3O2/c1-8(2)3-4-23-15(22)10-7-20-21(14(10)19)13-11(17)5-9(16)6-12(13)18/h3,5-7H,4,19H2,1-2H3