diethyl (3R,4R)-3,4-diethanoyl-2,5-diphenyl-pyrazole-3,4-dicarboxylate

Systemtic Name: diethyl (3R,4R)-3,4-diethanoyl-2,5-diphenyl-pyrazole-3,4-dicarboxylate Openeye Name: diethyl (3R,4R)-3,4-diacetyl-2,5-diphenyl-pyrazole-3,4-dicarboxylate CAS Name: (3R,4R)-3,4-diacetyl-2,5-diphenylpyrazole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3R,4R)-3,4-diacetyl-2,5-diphenylpyrazole-3,4-dicarboxylate Traditional Name: (3R,4R)-3,4-diacetyl-2,5-diphenyl-2-pyrazoline-3,4-dicarboxylic acid diethyl ester Formula: C25H26N2O6 MolecularWeight: 450.48374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=NN(C1(C(=O)C)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CCOC(=O)[C@]1(C(=NN([C@]1(C(=O)C)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C25H26N2O6/c1-5-32-22(30)24(17(3)28)21(19-13-9-7-10-14-19)26-27(20-15-11-8-12-16-20)25(24,18(4)29)23(31)33-6-2/h7-16H,5-6H2,1-4H3/t24-,25-/m1/s1