(4-bromanyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methyl 1-[(4-bromanyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: (4-bromanyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methyl 1-[(4-bromanyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: (4-bromo-2-methyl-5-oxo-1-phenyl-pyrazol-3-yl)methyl 1-[(4-bromo-2-methyl-5-oxo-1-phenyl-pyrazol-3-yl)methyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(4-bromo-2-methyl-5-oxo-1-phenyl-3-pyrazolyl)methyl]-4-phenyl-4-piperidinecarboxylic acid (4-bromo-2-methyl-5-oxo-1-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-bromo-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methyl 1-[(4-bromo-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[(4-bromo-5-keto-2-methyl-1-phenyl-3-pyrazolin-3-yl)methyl]-4-phenyl-isonipecotic acid (4-bromo-5-keto-2-methyl-1-phenyl-3-pyrazolin-3-yl)methyl ester Formula: C34H33Br2N5O4 MolecularWeight: 735.46492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3CCC(CC3)(C4=CC=CC=C4)C(=O)OCC5=C(C(=O)N(N5C)C6=CC=CC=C6)Br

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3CCC(CC3)(C4=CC=CC=C4)C(=O)OCC5=C(C(=O)N(N5C)C6=CC=CC=C6)Br

InChI

InChI=1S/C34H33Br2N5O4/c1-37-27(29(35)31(42)40(37)25-14-8-4-9-15-25)22-39-20-18-34(19-21-39,24-12-6-3-7-13-24)33(44)45-23-28-30(36)32(43)41(38(28)2)26-16-10-5-11-17-26/h3-17H,18-23H2,1-2H3