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

Systemtic Name: methyl 2-[2-(3-bromanylphenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[2-(3-bromophenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-(3-bromophenoxy)-1-oxopropyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(3-bromophenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[2-(3-bromophenoxy)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C18H18BrNO4S MolecularWeight: 424.30882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO4S/c1-10(24-12-6-3-5-11(19)9-12)16(21)20-17-15(18(22)23-2)13-7-4-8-14(13)25-17/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,20,21)