1-[4-(5-bromanylthiophen-2-yl)butanoyl]-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)butanoyl]-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(5-bromo-2-thienyl)butanoyl]-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[4-(5-bromo-2-thiophenyl)-1-oxobutyl]-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(5-bromothiophen-2-yl)butanoyl]-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(5-bromo-2-thienyl)butanoyl]-4-methoxy-proline Formula: C14H18BrNO4S MolecularWeight: 376.26602

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)CCCC2=CC=C(S2)Br)C(=O)O

Isomeric SMILES

COC1CC(N(C1)C(=O)CCCC2=CC=C(S2)Br)C(=O)O

InChI

InChI=1S/C14H18BrNO4S/c1-20-9-7-11(14(18)19)16(8-9)13(17)4-2-3-10-5-6-12(15)21-10/h5-6,9,11H,2-4,7-8H2,1H3,(H,18,19)