methyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[(2-bromo-3,4,5-trimethoxy-benzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[(2-bromo-3,4,5-trimethoxyphenyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(2-bromo-3,4,5-trimethoxy-benzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C19H20BrNO6S MolecularWeight: 470.3342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Br)OC)OC

InChI

InChI=1S/C19H20BrNO6S/c1-24-11-8-10(14(20)16(26-3)15(11)25-2)17(22)21-18-13(19(23)27-4)9-6-5-7-12(9)28-18/h8H,5-7H2,1-4H3,(H,21,22)