1-[3-bromanyl-4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-bromanyl-4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-bromo-4-(5-chloro-2-thienyl)-4-oxo-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-bromo-4-(5-chloro-2-thiophenyl)-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-bromo-4-(5-chlorothiophen-2-yl)-4-oxobutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-bromo-4-(5-chloro-2-thienyl)-4-keto-butanoyl]proline Formula: C13H13BrClNO4S MolecularWeight: 394.66862

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C(=O)C2=CC=C(S2)Cl)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CC(C(=O)C2=CC=C(S2)Cl)Br)C(=O)O

InChI

InChI=1S/C13H13BrClNO4S/c14-7(12(18)9-3-4-10(15)21-9)6-11(17)16-5-1-2-8(16)13(19)20/h3-4,7-8H,1-2,5-6H2,(H,19,20)