ethyl 2-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-bromo-2-ethyl-phenoxy)acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromo-2-ethylphenoxy)-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-bromo-2-ethylphenoxy)acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromo-2-ethyl-phenoxy)acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H22BrNO4S MolecularWeight: 440.35128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC2=C(C=C(C=C2)Br)CC)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC2=C(C=C(C=C2)Br)CC)C(=O)OCC

InChI

InChI=1S/C19H22BrNO4S/c1-4-12-9-13(20)7-8-16(12)25-11-17(22)21-18-15(19(23)24-6-3)10-14(5-2)26-18/h7-10H,4-6,11H2,1-3H3,(H,21,22)