dimethyl (4S)-2-(2-chloranylethanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Systemtic Name: dimethyl (4S)-2-(2-chloranylethanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Openeye Name: dimethyl (4S)-2-[(2-chloroacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate CAS Name: (4S)-2-[(2-chloro-1-oxoethyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4S)-2-[(2-chloroacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Traditional Name: (4S)-2-[(2-chloroacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C1C(=C(S2)NC(=O)CCl)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1CCC2=C1C(=C(S2)NC(=O)CCl)C(=O)OC

InChI

InChI=1S/C13H14ClNO5S/c1-19-12(17)6-3-4-7-9(6)10(13(18)20-2)11(21-7)15-8(16)5-14/h6H,3-5H2,1-2H3,(H,15,16)/t6-/m0/s1