dimethyl 5-[3-(3-bromanyl-4-methoxy-phenyl)propanoyloxy]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(3-bromanyl-4-methoxy-phenyl)propanoyloxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(3-bromo-4-methoxy-phenyl)propanoyloxy]benzene-1,3-dicarboxylate CAS Name: 5-[3-(3-bromo-4-methoxyphenyl)-1-oxopropoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(3-bromo-4-methoxyphenyl)propanoyloxy]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(3-bromo-4-methoxy-phenyl)propanoyloxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H19BrO7 MolecularWeight: 451.26466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)Br

InChI

InChI=1S/C20H19BrO7/c1-25-17-6-4-12(8-16(17)21)5-7-18(22)28-15-10-13(19(23)26-2)9-14(11-15)20(24)27-3/h4,6,8-11H,5,7H2,1-3H3