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

Systemtic Name: dimethyl 5-[2-[(5-bromanylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethoxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2-[allyl-[(5-bromo-2-thienyl)methyl]amino]-2-oxo-ethoxy]benzene-1,3-dicarboxylate CAS Name: 5-[2-[(5-bromo-2-thiophenyl)methyl-prop-2-enylamino]-2-oxoethoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-[(5-bromothiophen-2-yl)methyl-prop-2-enylamino]-2-oxoethoxy]benzene-1,3-dicarboxylate Traditional Name: 5-[2-[allyl-[(5-bromo-2-thienyl)methyl]amino]-2-keto-ethoxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H20BrNO6S MolecularWeight: 482.3449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)OCC(=O)N(CC=C)CC2=CC=C(S2)Br)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)OCC(=O)N(CC=C)CC2=CC=C(S2)Br)C(=O)OC

InChI

InChI=1S/C20H20BrNO6S/c1-4-7-22(11-16-5-6-17(21)29-16)18(23)12-28-15-9-13(19(24)26-2)8-14(10-15)20(25)27-3/h4-6,8-10H,1,7,11-12H2,2-3H3