[2-[[2,6-bis(chloranyl)-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl] 4-oxidanyl-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: [2-[[2,6-bis(chloranyl)-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl] 4-oxidanyl-1-phenyl-pyrazole-3-carboxylate Openeye Name: [2-(2,6-dichloro-3-methyl-anilino)-2-oxo-ethyl] 4-hydroxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-hydroxy-1-phenyl-3-pyrazolecarboxylic acid [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-hydroxy-1-phenyl-pyrazole-3-carboxylic acid [2-(2,6-dichloro-3-methyl-anilino)-2-keto-ethyl] ester Formula: C19H15Cl2N3O4 MolecularWeight: 420.2461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)COC(=O)C2=NN(C=C2O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)COC(=O)C2=NN(C=C2O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H15Cl2N3O4/c1-11-7-8-13(20)17(16(11)21)22-15(26)10-28-19(27)18-14(25)9-24(23-18)12-5-3-2-4-6-12/h2-9,25H,10H2,1H3,(H,22,26)