ethyl 4-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-5-chloranyl-2-methoxy-benzoate

Systemtic Name: ethyl 4-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-5-chloranyl-2-methoxy-benzoate Openeye Name: ethyl 4-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]-5-chloro-2-methoxy-benzoate CAS Name: 4-[[3-(2-bromo-4,5-dimethoxyphenyl)-1-oxopropyl]amino]-5-chloro-2-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-bromo-4,5-dimethoxyphenyl)propanoylamino]-5-chloro-2-methoxybenzoate Traditional Name: 4-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]-5-chloro-2-methoxy-benzoic acid ethyl ester Formula: C21H23BrClNO6 MolecularWeight: 500.76742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1OC)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1OC)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC)Cl

InChI

InChI=1S/C21H23BrClNO6/c1-5-30-21(26)13-9-15(23)16(11-17(13)27-2)24-20(25)7-6-12-8-18(28-3)19(29-4)10-14(12)22/h8-11H,5-7H2,1-4H3,(H,24,25)