methyl 4-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate

Systemtic Name: methyl 4-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: methyl 4-[3-(3-bromo-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(3-bromo-4,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(3-bromo-4,5-dimethoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(3-bromo-4,5-dimethoxy-phenyl)acryloyl]amino]benzoic acid methyl ester Formula: C19H18BrNO5 MolecularWeight: 420.25392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrNO5/c1-24-16-11-12(10-15(20)18(16)25-2)4-9-17(22)21-14-7-5-13(6-8-14)19(23)26-3/h4-11H,1-3H3,(H,21,22)