dimethyl 5-(4-bromophenyl)-1,2-diphenyl-pyrazolidine-3,3-dicarboxylate

Systemtic Name: dimethyl 5-(4-bromophenyl)-1,2-diphenyl-pyrazolidine-3,3-dicarboxylate Openeye Name: dimethyl 5-(4-bromophenyl)-1,2-diphenyl-pyrazolidine-3,3-dicarboxylate CAS Name: 5-(4-bromophenyl)-1,2-diphenylpyrazolidine-3,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4-bromophenyl)-1,2-diphenylpyrazolidine-3,3-dicarboxylate Traditional Name: 5-(4-bromophenyl)-1,2-diphenyl-pyrazolidine-3,3-dicarboxylic acid dimethyl ester Formula: C25H23BrN2O4 MolecularWeight: 495.36512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(N(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)C(=O)OC

Isomeric SMILES

COC(=O)C1(CC(N(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C25H23BrN2O4/c1-31-23(29)25(24(30)32-2)17-22(18-13-15-19(26)16-14-18)27(20-9-5-3-6-10-20)28(25)21-11-7-4-8-12-21/h3-16,22H,17H2,1-2H3