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

Systemtic Name: 1-[3-bromanyl-4-(4-tert-butylphenyl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-bromo-4-(4-tert-butylphenyl)-4-oxo-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-bromo-4-(4-tert-butylphenyl)-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-bromo-4-(4-tert-butylphenyl)-4-oxobutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-bromo-4-(4-tert-butylphenyl)-4-keto-butanoyl]proline Formula: C19H24BrNO4 MolecularWeight: 410.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C(CC(=O)N2CCCC2C(=O)O)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C(CC(=O)N2CCCC2C(=O)O)Br

InChI

InChI=1S/C19H24BrNO4/c1-19(2,3)13-8-6-12(7-9-13)17(23)14(20)11-16(22)21-10-4-5-15(21)18(24)25/h6-9,14-15H,4-5,10-11H2,1-3H3,(H,24,25)