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

Systemtic Name: methyl 2-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C19H20BrNO4S MolecularWeight: 438.3354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)C)Br

InChI

InChI=1S/C19H20BrNO4S/c1-10-7-12(20)8-11(2)17(10)25-9-15(22)21-18-16(19(23)24-3)13-5-4-6-14(13)26-18/h7-8H,4-6,9H2,1-3H3,(H,21,22)