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

Systemtic Name: methyl 2-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[2-(2-bromo-4-chloro-phenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2-bromo-4-chlorophenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[2-(2-bromo-4-chloro-phenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C18H17BrClNO4S MolecularWeight: 458.75388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)OC)OC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)OC)OC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C18H17BrClNO4S/c1-9(25-13-7-6-10(20)8-12(13)19)16(22)21-17-15(18(23)24-2)11-4-3-5-14(11)26-17/h6-9H,3-5H2,1-2H3,(H,21,22)