O4-methyl O1,O2-dipropan-2-yl 3-(4-bromophenyl)-3H-pyrazole-1,2,4-tricarboxylate

Systemtic Name: O4-methyl O1,O2-dipropan-2-yl 3-(4-bromophenyl)-3H-pyrazole-1,2,4-tricarboxylate Openeye Name: O1,O2-diisopropyl O4-methyl 3-(4-bromophenyl)-3H-pyrazole-1,2,4-tricarboxylate CAS Name: 3-(4-bromophenyl)-3H-pyrazole-1,2,4-tricarboxylic acid O4-methyl ester O1,O2-dipropan-2-yl ester IUPAC Name: 4-O-methyl 1-O,2-O-dipropan-2-yl 3-(4-bromophenyl)-3H-pyrazole-1,2,4-tricarboxylate Traditional Name: 3-(4-bromophenyl)-3-pyrazoline-1,2,4-tricarboxylic acid O1,O2-diisopropyl ester O4-methyl ester Formula: C19H23BrN2O6 MolecularWeight: 455.29972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1C=C(C(N1C(=O)OC(C)C)C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC(C)OC(=O)N1C=C(C(N1C(=O)OC(C)C)C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C19H23BrN2O6/c1-11(2)27-18(24)21-10-15(17(23)26-5)16(13-6-8-14(20)9-7-13)22(21)19(25)28-12(3)4/h6-12,16H,1-5H3