O3-ethyl O1-methyl 2-(3-bromanyl-4-methoxy-phenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-1,3-dicarboxylate

Systemtic Name: O3-ethyl O1-methyl 2-(3-bromanyl-4-methoxy-phenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-1,3-dicarboxylate Openeye Name: O3-ethyl O1-methyl 2-(3-bromo-4-methoxy-phenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-1,3-dicarboxylate CAS Name: 2-(3-bromo-4-methoxyphenyl)-5-[[(4-fluorophenyl)methylamino]-oxomethyl]pyrrolidine-1,3-dicarboxylic acid O3-ethyl ester O1-methyl ester IUPAC Name: 3-O-ethyl 1-O-methyl 2-(3-bromo-4-methoxyphenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-1,3-dicarboxylate Traditional Name: 2-(3-bromo-4-methoxy-phenyl)-5-[(4-fluorobenzyl)carbamoyl]pyrrolidine-1,3-dicarboxylic acid O3-ethyl ester O1-methyl ester Formula: C24H26BrFN2O6 MolecularWeight: 537.375443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC(=C(C=C2)OC)Br)C(=O)OC)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC(=C(C=C2)OC)Br)C(=O)OC)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C24H26BrFN2O6/c1-4-34-23(30)17-12-19(22(29)27-13-14-5-8-16(26)9-6-14)28(24(31)33-3)21(17)15-7-10-20(32-2)18(25)11-15/h5-11,17,19,21H,4,12-13H2,1-3H3,(H,27,29)