N-(4-bromanyl-2-methyl-phenyl)-5-oxidanylidene-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-5-oxidanylidene-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-5-oxo-1-(4-propoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-5-keto-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C21H23BrN2O3/c1-3-10-27-18-7-5-17(6-8-18)24-13-15(12-20(24)25)21(26)23-19-9-4-16(22)11-14(19)2/h4-9,11,15H,3,10,12-13H2,1-2H3,(H,23,26)