4-methyl-5-pyrrol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carboxylic acid

Systemtic Name: 4-methyl-5-pyrrol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carboxylic acid Openeye Name: 4-methyl-5-pyrrol-1-yl-1-(2,4,6-trichlorophenyl)pyrazole-3-carboxylic acid CAS Name: 4-methyl-5-(1-pyrrolyl)-1-(2,4,6-trichlorophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-methyl-5-pyrrol-1-yl-1-(2,4,6-trichlorophenyl)pyrazole-3-carboxylic acid Traditional Name: 4-methyl-5-pyrrol-1-yl-1-(2,4,6-trichlorophenyl)pyrazole-3-carboxylic acid Formula: C15H10Cl3N3O2 MolecularWeight: 370.6178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2Cl)Cl)Cl)N3C=CC=C3

Isomeric SMILES

CC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2Cl)Cl)Cl)N3C=CC=C3

InChI

InChI=1S/C15H10Cl3N3O2/c1-8-12(15(22)23)19-21(14(8)20-4-2-3-5-20)13-10(17)6-9(16)7-11(13)18/h2-7H,1H3,(H,22,23)