dimethyl 5-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethoxy]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethoxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-2-oxo-ethoxy]benzene-1,3-dicarboxylate CAS Name: 5-[2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-2-oxoethoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-[(5-bromothiophen-2-yl)methyl-ethylamino]-2-oxoethoxy]benzene-1,3-dicarboxylate Traditional Name: 5-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-2-keto-ethoxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H20BrNO6S MolecularWeight: 470.3342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)C(=O)COC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)C(=O)COC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H20BrNO6S/c1-4-21(10-15-5-6-16(20)28-15)17(22)11-27-14-8-12(18(23)25-2)7-13(9-14)19(24)26-3/h5-9H,4,10-11H2,1-3H3