dimethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[3-(3-bromo-4-methoxy-phenyl)prop-2-enoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[3-(3-bromo-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[3-(3-bromo-4-methoxyphenyl)prop-2-enoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[[3-(3-bromo-4-methoxy-phenyl)acryloyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H18BrNO6 MolecularWeight: 448.26402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)Br

InChI

InChI=1S/C20H18BrNO6/c1-26-17-8-4-12(10-15(17)21)5-9-18(23)22-16-11-13(19(24)27-2)6-7-14(16)20(25)28-3/h4-11H,1-3H3,(H,22,23)