dimethyl 2-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate CAS Name: 2-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Traditional Name: 2-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C23H26BrNO6S MolecularWeight: 524.42464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC

InChI

InChI=1S/C23H26BrNO6S/c1-23(2,3)14-10-12(24)6-8-15(14)31-11-17(26)25-20-19(22(28)30-5)18-13(21(27)29-4)7-9-16(18)32-20/h6,8,10,13H,7,9,11H2,1-5H3,(H,25,26)