N-(4-bromanyl-2,3-dimethyl-phenyl)-5-oxidanylidene-1-(1-phenylethyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2,3-dimethyl-phenyl)-5-oxidanylidene-1-(1-phenylethyl)pyrrolidine-3-carboxamide Openeye Name: N-(4-bromo-2,3-dimethyl-phenyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide CAS Name: N-(4-bromo-2,3-dimethylphenyl)-5-oxo-1-(1-phenylethyl)-3-pyrrolidinecarboxamide IUPAC Name: N-(4-bromo-2,3-dimethylphenyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide Traditional Name: N-(4-bromo-2,3-dimethyl-phenyl)-5-keto-1-(1-phenylethyl)pyrrolidine-3-carboxamide Formula: C21H23BrN2O2 MolecularWeight: 415.32352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)NC(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)NC(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3

InChI

InChI=1S/C21H23BrN2O2/c1-13-14(2)19(10-9-18(13)22)23-21(26)17-11-20(25)24(12-17)15(3)16-7-5-4-6-8-16/h4-10,15,17H,11-12H2,1-3H3,(H,23,26)