methyl 2-[[(E)-3-(4-bromanyl-3-chloranyl-phenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[[(E)-3-(4-bromanyl-3-chloranyl-phenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[(E)-3-(4-bromo-3-chloro-phenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[(E)-3-(4-bromo-3-chlorophenyl)-1-oxobut-2-enyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-bromo-3-chlorophenyl)but-2-enoyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[(E)-3-(4-bromo-3-chloro-phenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C20H19BrClNO5 MolecularWeight: 468.72556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC(=C(C=C1C(=O)OC)OC)OC)C2=CC(=C(C=C2)Br)Cl

Isomeric SMILES

C/C(=C\C(=O)NC1=CC(=C(C=C1C(=O)OC)OC)OC)/C2=CC(=C(C=C2)Br)Cl

InChI

InChI=1S/C20H19BrClNO5/c1-11(12-5-6-14(21)15(22)8-12)7-19(24)23-16-10-18(27-3)17(26-2)9-13(16)20(25)28-4/h5-10H,1-4H3,(H,23,24)/b11-7+