methyl 1-[4-(5-bromanylthiophen-2-yl)butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[4-(5-bromanylthiophen-2-yl)butanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[4-(5-bromo-2-thienyl)butanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[4-(5-bromo-2-thiophenyl)-1-oxobutyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(5-bromothiophen-2-yl)butanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[4-(5-bromo-2-thienyl)butanoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C14H18BrNO3S MolecularWeight: 360.26662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)CCCC2=CC=C(S2)Br

Isomeric SMILES

COC(=O)C1CCCN1C(=O)CCCC2=CC=C(S2)Br

InChI

InChI=1S/C14H18BrNO3S/c1-19-14(18)11-5-3-9-16(11)13(17)6-2-4-10-7-8-12(15)20-10/h7-8,11H,2-6,9H2,1H3