1-[3-bromanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-bromanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-bromo-4-oxo-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-bromo-1,4-dioxo-4-(4-phenylphenyl)butyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-bromo-4-oxo-4-(4-phenylphenyl)butanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-bromo-4-keto-4-(4-phenylphenyl)butanoyl]proline Formula: C21H20BrNO4 MolecularWeight: 430.2918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CC(C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Br)C(=O)O

InChI

InChI=1S/C21H20BrNO4/c22-17(13-19(24)23-12-4-7-18(23)21(26)27)20(25)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h1-3,5-6,8-11,17-18H,4,7,12-13H2,(H,26,27)