N-(4-bromanyl-2-ethyl-phenyl)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-ethyl-phenyl)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(4-bromo-2-ethyl-phenyl)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(4-bromo-2-ethylphenyl)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(4-bromo-2-ethylphenyl)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(4-bromo-2-ethyl-phenyl)-5-keto-1-p-phenetyl-pyrrolidine-3-carboxamide Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H23BrN2O3/c1-3-14-11-16(22)5-10-19(14)23-21(26)15-12-20(25)24(13-15)17-6-8-18(9-7-17)27-4-2/h5-11,15H,3-4,12-13H2,1-2H3,(H,23,26)